2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}benzoate

2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}benzoate

Formula: C32H23ClN2O8

SMILES: [O-][N+](=O)C1=CC=CC(Cl)=C1OC1=CC=C(C=C1)C(=O)COC(=O)C1=CC=C(C=C1)N1C(=O)C2C(C3C=CC2C2CC32)C1=O

IUPAC: 2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 4-{3,5-dioxo-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-en-4-yl}benzoate

InChI: InChI=1/C32H23ClN2O8/c33-24-2-1-3-25(35(40)41)29(24)43-19-10-6-16(7-11-19)26(36)15-42-32(39)17-4-8-18(9-5-17)34-30(37)27-20-12-13-21(23-14-22(20)23)28(27)31(34)38/h1-13,20-23,27-28H,14-15H2

Composition: C (64.17%), H (3.87%), Cl (5.92%), N (4.68%), O (21.37%)

Molar Mass: 598.99

Atom Count: 66

Heavy Atom Count: 43

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	6
Exact Mass	598.1142934
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	UETCURFXUHVMSX-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	153.9
Topological Polar Surface Area	133.12
Polarizability	58.79
Ring Count	7
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C32H23ClN2O8		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00