ethyl (E)-3-[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]-2-cyano-prop-2-enoate

Systemtic Name: ethyl (E)-3-[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]-2-cyano-prop-2-enoate Openeye Name: ethyl (E)-3-[1-[(2-chlorophenyl)methyl]-2-methyl-indol-3-yl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[1-[(2-chlorophenyl)methyl]-2-methyl-3-indolyl]-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-[(2-chlorophenyl)methyl]-2-methylindol-3-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[1-(2-chlorobenzyl)-2-methyl-indol-3-yl]-2-cyano-acrylic acid ethyl ester Formula: C22H19ClN2O2 MolecularWeight: 378.85146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3Cl)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3Cl)C)/C#N

InChI

InChI=1S/C22H19ClN2O2/c1-3-27-22(26)17(13-24)12-19-15(2)25(21-11-7-5-9-18(19)21)14-16-8-4-6-10-20(16)23/h4-12H,3,14H2,1-2H3/b17-12+