diethyl (Z)-2-(phenylmethoxycarbonylamino)-3-(trifluoromethyl)but-2-enedioate

Systemtic Name: diethyl (Z)-2-(phenylmethoxycarbonylamino)-3-(trifluoromethyl)but-2-enedioate Openeye Name: diethyl (Z)-2-(benzyloxycarbonylamino)-3-(trifluoromethyl)but-2-enedioate CAS Name: (Z)-2-(phenylmethoxycarbonylamino)-3-(trifluoromethyl)-2-butenedioic acid diethyl ester IUPAC Name: diethyl (Z)-2-(phenylmethoxycarbonylamino)-3-(trifluoromethyl)but-2-enedioate Traditional Name: (Z)-2-(benzyloxycarbonylamino)-3-(trifluoromethyl)but-2-enedioic acid diethyl ester Formula: C17H18F3NO6 MolecularWeight: 389.32313

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C(=O)OCC)NC(=O)OCC1=CC=CC=C1)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C17H18F3NO6/c1-3-25-14(22)12(17(18,19)20)13(15(23)26-4-2)21-16(24)27-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3,(H,21,24)/b13-12-