2-(3-nitrophenyl)-2-oxoethyl 1-(4-chlorobenzamido)-5-oxopyrrolidine-3-carboxylate

2-(3-nitrophenyl)-2-oxoethyl 1-(4-chlorobenzamido)-5-oxopyrrolidine-3-carboxylate

Formula: C20H16ClN3O7

SMILES: [O-][N+](=O)C1=CC(=CC=C1)C(=O)COC(=O)C1CN(NC(=O)C2=CC=C(Cl)C=C2)C(=O)C1

IUPAC: 2-(3-nitrophenyl)-2-oxoethyl 1-(4-chlorobenzamido)-5-oxopyrrolidine-3-carboxylate

InChI: InChI=1/C20H16ClN3O7/c21-15-6-4-12(5-7-15)19(27)22-23-10-14(9-18(23)26)20(28)31-11-17(25)13-2-1-3-16(8-13)24(29)30/h1-8,14H,9-11H2,(H,22,27)

Composition: C (53.88%), H (3.62%), Cl (7.95%), N (9.43%), O (25.12%)

Molar Mass: 445.81

Atom Count: 47

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	445.0676776
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	PEHHOIVIXFJKRN-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	107.68
Topological Polar Surface Area	135.92
Polarizability	40.91
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H16ClN3O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00