dimethyl 5-[[4-methyl-1-oxidanylidene-4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-3H-isoquinolin-2-yl]methyl]-1,3-dihydroindene-2,2-dicarboxylate

Systemtic Name: dimethyl 5-[[4-methyl-1-oxidanylidene-4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-3H-isoquinolin-2-yl]methyl]-1,3-dihydroindene-2,2-dicarboxylate Openeye Name: dimethyl 5-[[4-methyl-1-oxo-4-[2-oxo-2-(2-thienyl)ethyl]-3H-isoquinolin-2-yl]methyl]indane-2,2-dicarboxylate CAS Name: 5-[[4-methyl-1-oxo-4-(2-oxo-2-thiophen-2-ylethyl)-3H-isoquinolin-2-yl]methyl]-1,3-dihydroindene-2,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-methyl-1-oxo-4-(2-oxo-2-thiophen-2-ylethyl)-3H-isoquinolin-2-yl]methyl]-1,3-dihydroindene-2,2-dicarboxylate Traditional Name: 5-[[1-keto-4-[2-keto-2-(2-thienyl)ethyl]-4-methyl-3H-isoquinolin-2-yl]methyl]indane-2,2-dicarboxylic acid dimethyl ester Formula: C30H29NO6S MolecularWeight: 531.61936

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)C2=CC=CC=C21)CC3=CC4=C(CC(C4)(C(=O)OC)C(=O)OC)C=C3)CC(=O)C5=CC=CS5

Isomeric SMILES

CC1(CN(C(=O)C2=CC=CC=C21)CC3=CC4=C(CC(C4)(C(=O)OC)C(=O)OC)C=C3)CC(=O)C5=CC=CS5

InChI

InChI=1S/C30H29NO6S/c1-29(16-24(32)25-9-6-12-38-25)18-31(26(33)22-7-4-5-8-23(22)29)17-19-10-11-20-14-30(27(34)36-2,28(35)37-3)15-21(20)13-19/h4-13H,14-18H2,1-3H3