diethyl 2-[(S)-(4-chlorophenyl)-(1H-indol-3-yl)methyl]propanedioate

Systemtic Name: diethyl 2-[(S)-(4-chlorophenyl)-(1H-indol-3-yl)methyl]propanedioate Openeye Name: diethyl 2-[(S)-(4-chlorophenyl)-(1H-indol-3-yl)methyl]propanedioate CAS Name: 2-[(S)-(4-chlorophenyl)-(1H-indol-3-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(S)-(4-chlorophenyl)-(1H-indol-3-yl)methyl]propanedioate Traditional Name: 2-[(S)-(4-chlorophenyl)-(1H-indol-3-yl)methyl]malonic acid diethyl ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)Cl)C2=CNC3=CC=CC=C32)C(=O)OCC

Isomeric SMILES

CCOC(=O)C([C@@H](C1=CC=C(C=C1)Cl)C2=CNC3=CC=CC=C32)C(=O)OCC

InChI

InChI=1S/C22H22ClNO4/c1-3-27-21(25)20(22(26)28-4-2)19(14-9-11-15(23)12-10-14)17-13-24-18-8-6-5-7-16(17)18/h5-13,19-20,24H,3-4H2,1-2H3/t19-/m0/s1