(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CC(C1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C[C@H](C1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C17H19N3O4/c1-11(19)14(9-18)16(22)10-24-17(23)8-15(20-12(2)21)13-6-4-3-5-7-13/h3-7,14-15,19H,8,10H2,1-2H3,(H,20,21)/t14?,15-/m1/s1