2-[4-(3-cyanophenyl)carbonylpiperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-cyanophenyl)carbonylpiperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-cyanobenzoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-[(3-cyanophenyl)-oxomethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3-cyanobenzoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(3-cyanobenzoyl)piperazino]acetic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1CN(CCN1CC(=O)O)C(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H15N3O3/c15-9-11-2-1-3-12(8-11)14(20)17-6-4-16(5-7-17)10-13(18)19/h1-3,8H,4-7,10H2,(H,18,19)