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

Systemtic Name: (phenylmethyl) 2-methyl-11-nitroso-6-oxidanyl-naphtho[2,3-b]indolizine-12-carboxylate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C25H18N2O4 MolecularWeight: 410.42142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C3=C(C4=CC=CC=C4C(=C3N2C=C1)O)N=O)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C3=C(C4=CC=CC=C4C(=C3N2C=C1)O)N=O)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C25H18N2O4/c1-15-11-12-27-19(13-15)20(25(29)31-14-16-7-3-2-4-8-16)21-22(26-30)17-9-5-6-10-18(17)24(28)23(21)27/h2-13,28H,14H2,1H3