[2-[2-(1H-indol-3-yl)ethyl]-7-methyl-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isoquinolin-7-yl] cyclopentanecarboxylate

Systemtic Name: [2-[2-(1H-indol-3-yl)ethyl]-7-methyl-6,8-bis(oxidanylidene)-3-thiophen-3-yl-isoquinolin-7-yl] cyclopentanecarboxylate Openeye Name: [2-[2-(1H-indol-3-yl)ethyl]-7-methyl-6,8-dioxo-3-(3-thienyl)-7-isoquinolyl] cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [2-[2-(1H-indol-3-yl)ethyl]-7-methyl-6,8-dioxo-3-(3-thiophenyl)-7-isoquinolinyl] ester IUPAC Name: [2-[2-(1H-indol-3-yl)ethyl]-7-methyl-6,8-dioxo-3-thiophen-3-ylisoquinolin-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-[2-(1H-indol-3-yl)ethyl]-6,8-diketo-7-methyl-3-(3-thienyl)-7-isoquinolyl] ester Formula: C30H28N2O4S MolecularWeight: 512.61932

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CCC3=CNC4=CC=CC=C43)C5=CSC=C5)OC(=O)C6CCCC6

Isomeric SMILES

CC1(C(=O)C=C2C=C(N(C=C2C1=O)CCC3=CNC4=CC=CC=C43)C5=CSC=C5)OC(=O)C6CCCC6

InChI

InChI=1S/C30H28N2O4S/c1-30(36-29(35)19-6-2-3-7-19)27(33)15-22-14-26(21-11-13-37-18-21)32(17-24(22)28(30)34)12-10-20-16-31-25-9-5-4-8-23(20)25/h4-5,8-9,11,13-19,31H,2-3,6-7,10,12H2,1H3