ethyl 1-cyclopropyl-8-[7-methoxy-2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]-9-methyl-4-oxidanylidene-quinolizine-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-8-[7-methoxy-2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]-9-methyl-4-oxidanylidene-quinolizine-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-8-(7-methoxy-2-trityl-isoindolin-5-yl)-9-methyl-4-oxo-quinolizine-3-carboxylate CAS Name: 1-cyclopropyl-8-[7-methoxy-2-(triphenylmethyl)-1,3-dihydroisoindol-5-yl]-9-methyl-4-oxo-3-quinolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-8-(7-methoxy-2-trityl-1,3-dihydroisoindol-5-yl)-9-methyl-4-oxoquinolizine-3-carboxylate Traditional Name: 1-cyclopropyl-4-keto-8-(7-methoxy-2-trityl-isoindolin-5-yl)-9-methyl-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(CN(C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=C3)OC)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)OC)C)C8CC8

InChI

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