dimethyl 1-(phenylmethyl)-4-thiophen-2-yl-2,3,5,6-tetrahydroindole-6,7-dicarboxylate

Systemtic Name: dimethyl 1-(phenylmethyl)-4-thiophen-2-yl-2,3,5,6-tetrahydroindole-6,7-dicarboxylate Openeye Name: dimethyl 1-benzyl-4-(2-thienyl)-2,3,5,6-tetrahydroindole-6,7-dicarboxylate CAS Name: 1-(phenylmethyl)-4-thiophen-2-yl-2,3,5,6-tetrahydroindole-6,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-benzyl-4-thiophen-2-yl-2,3,5,6-tetrahydroindole-6,7-dicarboxylate Traditional Name: 1-benzyl-4-(2-thienyl)-2,3,5,6-tetrahydroindole-6,7-dicarboxylic acid dimethyl ester Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=C2CCN(C2=C1C(=O)OC)CC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

COC(=O)C1CC(=C2CCN(C2=C1C(=O)OC)CC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H23NO4S/c1-27-22(25)18-13-17(19-9-6-12-29-19)16-10-11-24(14-15-7-4-3-5-8-15)21(16)20(18)23(26)28-2/h3-9,12,18H,10-11,13-14H2,1-2H3