[3-(4-methoxy-4-oxidanylidene-butyl)-7-methyl-6,8-bis(oxidanylidene)-5-phenyl-2-(2-pyridin-2-ylethyl)isoquinolin-7-yl] cyclopentanecarboxylate

Systemtic Name: [3-(4-methoxy-4-oxidanylidene-butyl)-7-methyl-6,8-bis(oxidanylidene)-5-phenyl-2-(2-pyridin-2-ylethyl)isoquinolin-7-yl] cyclopentanecarboxylate Openeye Name: [3-(4-methoxy-4-oxo-butyl)-7-methyl-6,8-dioxo-5-phenyl-2-[2-(2-pyridyl)ethyl]-7-isoquinolyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenyl-2-[2-(2-pyridinyl)ethyl]-7-isoquinolinyl] ester IUPAC Name: [3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenyl-2-(2-pyridin-2-ylethyl)isoquinolin-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [6,8-diketo-3-(4-keto-4-methoxy-butyl)-7-methyl-5-phenyl-2-[2-(2-pyridyl)ethyl]-7-isoquinolyl] ester Formula: C34H36N2O6 MolecularWeight: 568.65944

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C3=CC=CC=C3)CCCC(=O)OC)CCC4=CC=CC=N4)OC(=O)C5CCCC5

Isomeric SMILES

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C3=CC=CC=C3)CCCC(=O)OC)CCC4=CC=CC=N4)OC(=O)C5CCCC5

InChI

InChI=1S/C34H36N2O6/c1-34(42-33(40)24-13-6-7-14-24)31(38)28-22-36(20-18-25-15-8-9-19-35-25)26(16-10-17-29(37)41-2)21-27(28)30(32(34)39)23-11-4-3-5-12-23/h3-5,8-9,11-12,15,19,21-22,24H,6-7,10,13-14,16-18,20H2,1-2H3