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

Systemtic Name: [3-(4-methoxy-4-oxidanylidene-butyl)-7-methyl-6,8-bis(oxidanylidene)-5-phenyl-2-(phenylmethyl)isoquinolin-7-yl] cyclopentanecarboxylate Openeye Name: [2-benzyl-3-(4-methoxy-4-oxo-butyl)-7-methyl-6,8-dioxo-5-phenyl-7-isoquinolyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenyl-2-(phenylmethyl)-7-isoquinolinyl] ester IUPAC Name: [2-benzyl-3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenylisoquinolin-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-benzyl-6,8-diketo-3-(4-keto-4-methoxy-butyl)-7-methyl-5-phenyl-7-isoquinolyl] ester Formula: C34H35NO6 MolecularWeight: 553.6448

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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)CC4=CC=CC=C4)OC(=O)C5CCCC5

Isomeric SMILES

CC1(C(=O)C2=CN(C(=CC2=C(C1=O)C3=CC=CC=C3)CCCC(=O)OC)CC4=CC=CC=C4)OC(=O)C5CCCC5

InChI

InChI=1S/C34H35NO6/c1-34(41-33(39)25-16-9-10-17-25)31(37)28-22-35(21-23-12-5-3-6-13-23)26(18-11-19-29(36)40-2)20-27(28)30(32(34)38)24-14-7-4-8-15-24/h3-8,12-15,20,22,25H,9-11,16-19,21H2,1-2H3