ethyl (Z)-3-cyano-3-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)prop-2-enoate

Systemtic Name: ethyl (Z)-3-cyano-3-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)prop-2-enoate Openeye Name: ethyl (Z)-3-(benzyloxycarbonylamino)-3-cyano-2-(trifluoromethyl)prop-2-enoate CAS Name: (Z)-3-cyano-3-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-cyano-3-(phenylmethoxycarbonylamino)-2-(trifluoromethyl)prop-2-enoate Traditional Name: (Z)-3-(benzyloxycarbonylamino)-3-cyano-2-(trifluoromethyl)acrylic acid ethyl ester Formula: C15H13F3N2O4 MolecularWeight: 342.26993

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C#N)NC(=O)OCC1=CC=CC=C1)C(F)(F)F

Isomeric SMILES

CCOC(=O)/C(=C(\C#N)/NC(=O)OCC1=CC=CC=C1)/C(F)(F)F

InChI

InChI=1S/C15H13F3N2O4/c1-2-23-13(21)12(15(16,17)18)11(8-19)20-14(22)24-9-10-6-4-3-5-7-10/h3-7H,2,9H2,1H3,(H,20,22)/b12-11-