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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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