ethyl N-[(Z)-2-cyano-3-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]prop-2-enoyl]carbamate

Systemtic Name: ethyl N-[(Z)-2-cyano-3-[[(1S)-2-oxidanyl-1-phenyl-ethyl]amino]prop-2-enoyl]carbamate Openeye Name: ethyl N-[(Z)-2-cyano-3-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]prop-2-enoyl]carbamate CAS Name: N-[(Z)-2-cyano-3-[[(1S)-2-hydroxy-1-phenylethyl]amino]-1-oxoprop-2-enyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[(Z)-2-cyano-3-[[(1S)-2-hydroxy-1-phenylethyl]amino]prop-2-enoyl]carbamate Traditional Name: N-[(Z)-2-cyano-3-[[(1S)-2-hydroxy-1-phenyl-ethyl]amino]acryloyl]carbamic acid ethyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)C(=CNC(CO)C1=CC=CC=C1)C#N

Isomeric SMILES

CCOC(=O)NC(=O)/C(=C\N[C@H](CO)C1=CC=CC=C1)/C#N

InChI

InChI=1S/C15H17N3O4/c1-2-22-15(21)18-14(20)12(8-16)9-17-13(10-19)11-6-4-3-5-7-11/h3-7,9,13,17,19H,2,10H2,1H3,(H,18,20,21)/b12-9-/t13-/m1/s1