ethyl 1-cyclopropyl-9-methyl-4-oxidanylidene-8-[2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]quinolizine-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-9-methyl-4-oxidanylidene-8-[2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]quinolizine-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-9-methyl-4-oxo-8-(2-tritylisoindolin-5-yl)quinolizine-3-carboxylate CAS Name: 1-cyclopropyl-9-methyl-4-oxo-8-[2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]-3-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-9-methyl-4-oxo-8-(2-trityl-1,3-dihydroisoindol-5-yl)quinolizine-3-carboxylate Traditional Name: 1-cyclopropyl-4-keto-9-methyl-8-(2-tritylisoindolin-5-yl)quinolizine-3-carboxylic acid ethyl ester Formula: C43H38N2O3 MolecularWeight: 630.77342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C(=C(C=CN2C1=O)C3=CC4=C(CN(C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C=C3)C)C8CC8

Isomeric SMILES

CCOC(=O)C1=CC(=C2C(=C(C=CN2C1=O)C3=CC4=C(CN(C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C=C3)C)C8CC8

InChI

InChI=1S/C43H38N2O3/c1-3-48-42(47)39-26-38(30-19-20-30)40-29(2)37(23-24-45(40)41(39)46)31-21-22-32-27-44(28-33(32)25-31)43(34-13-7-4-8-14-34,35-15-9-5-10-16-35)36-17-11-6-12-18-36/h4-18,21-26,30H,3,19-20,27-28H2,1-2H3