3-oxa-20-azapentacyclo[11.7.0.0²,¹?.0?,?.0¹?,¹?]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene

3-oxa-20-azapentacyclo[11.7.0.0²,¹?.0?,?.0¹?,¹?]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene

CAS: 1338919-70-2

Formula: C18H11NO

SMILES: N1C2=C(C=CC=C2)C2=C1C1=C(C=C2)C2=C(O1)C=CC=C2

IUPAC: 3-oxa-20-azapentacyclo[11.7.0.0²,¹?.0?,?.0¹?,¹?]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaene

InChI: InChI=1S/C18H11NO/c1-3-7-15-11(5-1)13-9-10-14-12-6-2-4-8-16(12)20-18(14)17(13)19-15/h1-10,19H

Composition: C (84.03%), H (4.31%), N (5.44%), O (6.22%)

Molar Mass: 257.292

Atom Count: 31

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	5
Asymmetric Atom Count	0
Exact Mass	257.084063978
Formal Charge	0
FSP3	0
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
InChIKey	DZINJFQFEBORIC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.64
Topological Polar Surface Area	28.93
Polarizability	35.39
Ring Count	5
Rotatable Bond Count	0

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