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

Systemtic Name: ethyl 1-cyclopropyl-9-methoxy-8-[1-methyl-2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]-4-oxidanylidene-quinolizine-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-9-methoxy-8-(1-methyl-2-trityl-isoindolin-5-yl)-4-oxo-quinolizine-3-carboxylate CAS Name: 1-cyclopropyl-9-methoxy-8-[1-methyl-2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]-4-oxo-3-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-9-methoxy-8-(1-methyl-2-trityl-1,3-dihydroisoindol-5-yl)-4-oxoquinolizine-3-carboxylate Traditional Name: 1-cyclopropyl-4-keto-9-methoxy-8-(1-methyl-2-trityl-isoindolin-5-yl)quinolizine-3-carboxylic acid ethyl ester Formula: C44H40N2O4 MolecularWeight: 660.7994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C44H40N2O4/c1-4-50-43(48)39-27-38(30-20-21-30)40-41(49-3)37(24-25-45(40)42(39)47)31-22-23-36-29(2)46(28-32(36)26-31)44(33-14-8-5-9-15-33,34-16-10-6-11-17-34)35-18-12-7-13-19-35/h5-19,22-27,29-30H,4,20-21,28H2,1-3H3