methyl 2-cyano-2-[1-(2-cyanoethyl)-2-phenyl-indol-3-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[1-(2-cyanoethyl)-2-phenyl-indol-3-yl]ethanoate Openeye Name: methyl 2-cyano-2-[1-(2-cyanoethyl)-2-phenyl-indol-3-yl]acetate CAS Name: 2-cyano-2-[1-(2-cyanoethyl)-2-phenyl-3-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[1-(2-cyanoethyl)-2-phenylindol-3-yl]acetate Traditional Name: 2-cyano-2-[1-(2-cyanoethyl)-2-phenyl-indol-3-yl]acetic acid methyl ester Formula: C21H17N3O2 MolecularWeight: 343.37858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N3O2/c1-26-21(25)17(14-23)19-16-10-5-6-11-18(16)24(13-7-12-22)20(19)15-8-3-2-4-9-15/h2-6,8-11,17H,7,13H2,1H3