dimethyl 1-[(3-cyanophenyl)methyl]indole-2,3-dicarboxylate

Systemtic Name: dimethyl 1-[(3-cyanophenyl)methyl]indole-2,3-dicarboxylate Openeye Name: dimethyl 1-[(3-cyanophenyl)methyl]indole-2,3-dicarboxylate CAS Name: 1-[(3-cyanophenyl)methyl]indole-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-[(3-cyanophenyl)methyl]indole-2,3-dicarboxylate Traditional Name: 1-(3-cyanobenzyl)indole-2,3-dicarboxylic acid dimethyl ester Formula: C20H16N2O4 MolecularWeight: 348.35204

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC(=C3)C#N)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC(=C3)C#N)C(=O)OC

InChI

InChI=1S/C20H16N2O4/c1-25-19(23)17-15-8-3-4-9-16(15)22(18(17)20(24)26-2)12-14-7-5-6-13(10-14)11-21/h3-10H,12H2,1-2H3