ethyl (Z)-2-cyano-3-[(phenylmethyl)amino]-3-[[4-(trifluoromethyl)phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (Z)-2-cyano-3-[(phenylmethyl)amino]-3-[[4-(trifluoromethyl)phenyl]amino]prop-2-enoate Openeye Name: ethyl (Z)-3-(benzylamino)-2-cyano-3-[4-(trifluoromethyl)anilino]prop-2-enoate CAS Name: (Z)-2-cyano-3-[(phenylmethyl)amino]-3-[4-(trifluoromethyl)anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-(benzylamino)-2-cyano-3-[4-(trifluoromethyl)anilino]prop-2-enoate Traditional Name: (Z)-3-(benzylamino)-2-cyano-3-[4-(trifluoromethyl)anilino]acrylic acid ethyl ester Formula: C20H18F3N3O2 MolecularWeight: 389.37103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(NCC1=CC=CC=C1)NC2=CC=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CCOC(=O)/C(=C(/NCC1=CC=CC=C1)\NC2=CC=C(C=C2)C(F)(F)F)/C#N

InChI

InChI=1S/C20H18F3N3O2/c1-2-28-19(27)17(12-24)18(25-13-14-6-4-3-5-7-14)26-16-10-8-15(9-11-16)20(21,22)23/h3-11,25-26H,2,13H2,1H3/b18-17-