(E,2S)-4-(4-ethanoylphenyl)-2-(phenylmethoxycarbonylamino)but-3-enoic acid

Systemtic Name: (E,2S)-4-(4-ethanoylphenyl)-2-(phenylmethoxycarbonylamino)but-3-enoic acid Openeye Name: (E,2S)-4-(4-acetylphenyl)-2-(benzyloxycarbonylamino)but-3-enoic acid CAS Name: (E,2S)-4-(4-acetylphenyl)-2-(phenylmethoxycarbonylamino)-3-butenoic acid IUPAC Name: (E,2S)-4-(4-acetylphenyl)-2-(phenylmethoxycarbonylamino)but-3-enoic acid Traditional Name: (E,2S)-4-(4-acetylphenyl)-2-(benzyloxycarbonylamino)but-3-enoic acid Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C=CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)/C=C/[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H19NO5/c1-14(22)17-10-7-15(8-11-17)9-12-18(19(23)24)21-20(25)26-13-16-5-3-2-4-6-16/h2-12,18H,13H2,1H3,(H,21,25)(H,23,24)/b12-9+/t18-/m0/s1