octyl 11-nitroso-6-oxidanyl-naphtho[2,3-b]indolizine-12-carboxylate

Systemtic Name: octyl 11-nitroso-6-oxidanyl-naphtho[2,3-b]indolizine-12-carboxylate Openeye Name: octyl 6-hydroxy-11-nitroso-naphtho[2,3-b]indolizine-12-carboxylate CAS Name: 6-hydroxy-11-nitroso-12-naphtho[2,3-b]indolizinecarboxylic acid octyl ester IUPAC Name: octyl 6-hydroxy-11-nitrosonaphtho[2,3-b]indolizine-12-carboxylate Traditional Name: 6-hydroxy-11-nitroso-naphth[2,3-b]indolizine-12-carboxylic acid octyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=C2C=CC=CN2C3=C(C4=CC=CC=C4C(=C13)N=O)O

Isomeric SMILES

CCCCCCCCOC(=O)C1=C2C=CC=CN2C3=C(C4=CC=CC=C4C(=C13)N=O)O

InChI

InChI=1S/C25H26N2O4/c1-2-3-4-5-6-11-16-31-25(29)20-19-14-9-10-15-27(19)23-21(20)22(26-30)17-12-7-8-13-18(17)24(23)28/h7-10,12-15,28H,2-6,11,16H2,1H3