[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-acetamidobenzoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-acetamidobenzoate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)NC(=O)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)NC(=O)C

InChI

InChI=1S/C22H25N3O4/c1-16(29-22(28)18-7-6-8-19(15-18)23-17(2)26)21(27)25-13-11-24(12-14-25)20-9-4-3-5-10-20/h3-10,15-16H,11-14H2,1-2H3,(H,23,26)