dimethyl 2-[1-(phenylmethyl)indol-3-yl]propanedioate

Systemtic Name: dimethyl 2-[1-(phenylmethyl)indol-3-yl]propanedioate Openeye Name: dimethyl 2-(1-benzylindol-3-yl)propanedioate CAS Name: 2-[1-(phenylmethyl)-3-indolyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(1-benzylindol-3-yl)propanedioate Traditional Name: 2-(1-benzylindol-3-yl)malonic acid dimethyl ester Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO4/c1-24-19(22)18(20(23)25-2)16-13-21(12-14-8-4-3-5-9-14)17-11-7-6-10-15(16)17/h3-11,13,18H,12H2,1-2H3