ethyl (E)-4-[[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]-(phenylcarbonyl)amino]but-2-enoate

Systemtic Name: ethyl (E)-4-[[(2S)-1-ethoxy-1-oxidanylidene-propan-2-yl]-(phenylcarbonyl)amino]but-2-enoate Openeye Name: ethyl (E)-4-[benzoyl-[(1S)-2-ethoxy-1-methyl-2-oxo-ethyl]amino]but-2-enoate CAS Name: (E)-4-[benzoyl-[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[benzoyl-[(2S)-1-ethoxy-1-oxopropan-2-yl]amino]but-2-enoate Traditional Name: (E)-4-[benzoyl-[(1S)-2-ethoxy-2-keto-1-methyl-ethyl]amino]but-2-enoic acid ethyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCN(C(C)C(=O)OCC)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)/C=C/CN([C@@H](C)C(=O)OCC)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H23NO5/c1-4-23-16(20)12-9-13-19(14(3)18(22)24-5-2)17(21)15-10-7-6-8-11-15/h6-12,14H,4-5,13H2,1-3H3/b12-9+/t14-/m0/s1