diethyl 1-(phenylmethyl)indole-2,3-dicarboxylate

Systemtic Name: diethyl 1-(phenylmethyl)indole-2,3-dicarboxylate Openeye Name: diethyl 1-benzylindole-2,3-dicarboxylate CAS Name: 1-(phenylmethyl)indole-2,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-benzylindole-2,3-dicarboxylate Traditional Name: 1-benzylindole-2,3-dicarboxylic acid diethyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C21H21NO4/c1-3-25-20(23)18-16-12-8-9-13-17(16)22(19(18)21(24)26-4-2)14-15-10-6-5-7-11-15/h5-13H,3-4,14H2,1-2H3