2-cyano-2-[1-[(E)-1-oxidanyl-3-oxidanylidene-1-phenylazanyl-but-1-en-2-yl]cyclopentyl]ethanamide

Systemtic Name: 2-cyano-2-[1-[(E)-1-oxidanyl-3-oxidanylidene-1-phenylazanyl-but-1-en-2-yl]cyclopentyl]ethanamide Openeye Name: 2-[1-[(1E)-1-[anilino(hydroxy)methylene]-2-oxo-propyl]cyclopentyl]-2-cyano-acetamide CAS Name: 2-[1-[(E)-1-anilino-1-hydroxy-3-oxobut-1-en-2-yl]cyclopentyl]-2-cyanoacetamide IUPAC Name: 2-[1-[(E)-1-anilino-1-hydroxy-3-oxobut-1-en-2-yl]cyclopentyl]-2-cyanoacetamide Traditional Name: 2-[1-[(E)-1-acetyl-2-anilino-2-hydroxy-vinyl]cyclopentyl]-2-cyano-acetamide Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(NC1=CC=CC=C1)O)C2(CCCC2)C(C#N)C(=O)N

Isomeric SMILES

CC(=O)/C(=C(\NC1=CC=CC=C1)/O)/C2(CCCC2)C(C#N)C(=O)N

InChI

InChI=1S/C18H21N3O3/c1-12(22)15(17(24)21-13-7-3-2-4-8-13)18(9-5-6-10-18)14(11-19)16(20)23/h2-4,7-8,14,21,24H,5-6,9-10H2,1H3,(H2,20,23)/b17-15-