O1-ethyl O3-methyl 2-[1H-indol-3-yl(phenyl)methyl]propanedioate

Systemtic Name: O1-ethyl O3-methyl 2-[1H-indol-3-yl(phenyl)methyl]propanedioate Openeye Name: O1-ethyl O3-methyl 2-[1H-indol-3-yl(phenyl)methyl]propanedioate CAS Name: 2-[1H-indol-3-yl(phenyl)methyl]propanedioic acid O1-ethyl ester O3-methyl ester IUPAC Name: 1-O-ethyl 3-O-methyl 2-[1H-indol-3-yl(phenyl)methyl]propanedioate Traditional Name: 2-[1H-indol-3-yl(phenyl)methyl]malonic acid O1-ethyl ester O3-methyl ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)C2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCOC(=O)C(C(C1=CC=CC=C1)C2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H21NO4/c1-3-26-21(24)19(20(23)25-2)18(14-9-5-4-6-10-14)16-13-22-17-12-8-7-11-15(16)17/h4-13,18-19,22H,3H2,1-2H3