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

Systemtic Name: [3-(4-methoxy-4-oxidanylidene-butyl)-7-methyl-6,8-bis(oxidanylidene)-5-phenyl-2-(3-propan-2-yloxypropyl)isoquinolin-7-yl] cyclopentanecarboxylate Openeye Name: [2-(3-isopropoxypropyl)-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-(3-propan-2-yloxypropyl)-7-isoquinolinyl] ester IUPAC Name: [3-(4-methoxy-4-oxobutyl)-7-methyl-6,8-dioxo-5-phenyl-2-(3-propan-2-yloxypropyl)isoquinolin-7-yl] cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [2-(3-isopropoxypropyl)-6,8-diketo-3-(4-keto-4-methoxy-butyl)-7-methyl-5-phenyl-7-isoquinolyl] ester Formula: C33H41NO7 MolecularWeight: 563.68114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C=C2C(=C(C(=O)C(C2=O)(C)OC(=O)C3CCCC3)C4=CC=CC=C4)C=C1CCCC(=O)OC

Isomeric SMILES

CC(C)OCCCN1C=C2C(=C(C(=O)C(C2=O)(C)OC(=O)C3CCCC3)C4=CC=CC=C4)C=C1CCCC(=O)OC

InChI

InChI=1S/C33H41NO7/c1-22(2)40-19-11-18-34-21-27-26(20-25(34)16-10-17-28(35)39-4)29(23-12-6-5-7-13-23)31(37)33(3,30(27)36)41-32(38)24-14-8-9-15-24/h5-7,12-13,20-22,24H,8-11,14-19H2,1-4H3