(2-cyanophenyl)methyl 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate

Systemtic Name: (2-cyanophenyl)methyl 4-(4-ethanoylpiperazin-1-yl)-4-oxidanylidene-butanoate Openeye Name: (2-cyanophenyl)methyl 4-(4-acetylpiperazin-1-yl)-4-oxo-butanoate CAS Name: 4-(4-acetyl-1-piperazinyl)-4-oxobutanoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 4-(4-acetylpiperazin-1-yl)-4-oxobutanoate Traditional Name: 4-(4-acetylpiperazino)-4-keto-butyric acid (2-cyanobenzyl) ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CCC(=O)OCC2=CC=CC=C2C#N

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CCC(=O)OCC2=CC=CC=C2C#N

InChI

InChI=1S/C18H21N3O4/c1-14(22)20-8-10-21(11-9-20)17(23)6-7-18(24)25-13-16-5-3-2-4-15(16)12-19/h2-5H,6-11,13H2,1H3