ethyl (2S)-2-(2-chloranylethanoyl)-3-[(4-ethoxyphenyl)amino]but-3-enoate

Systemtic Name: ethyl (2S)-2-(2-chloranylethanoyl)-3-[(4-ethoxyphenyl)amino]but-3-enoate Openeye Name: ethyl (2S)-2-(2-chloroacetyl)-3-(4-ethoxyanilino)but-3-enoate CAS Name: (2S)-2-(2-chloro-1-oxoethyl)-3-(4-ethoxyanilino)-3-butenoic acid ethyl ester IUPAC Name: ethyl (2S)-2-(2-chloroacetyl)-3-(4-ethoxyanilino)but-3-enoate Traditional Name: (2S)-2-(2-chloroacetyl)-3-(p-phenetidino)but-3-enoic acid ethyl ester Formula: C16H20ClNO4 MolecularWeight: 325.7873

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=C)C(C(=O)CCl)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=C)[C@@H](C(=O)CCl)C(=O)OCC

InChI

InChI=1S/C16H20ClNO4/c1-4-21-13-8-6-12(7-9-13)18-11(3)15(14(19)10-17)16(20)22-5-2/h6-9,15,18H,3-5,10H2,1-2H3/t15-/m0/s1