5-acetamido-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]benzoic acid

Systemtic Name: 5-acetamido-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]benzoic acid Openeye Name: 5-acetamido-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-1-yl]benzoic acid CAS Name: 5-acetamido-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]benzoic acid IUPAC Name: 5-acetamido-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]benzoic acid Traditional Name: 5-acetamido-2-[4-(2-keto-2-pyrrolidino-ethyl)piperazino]benzoic acid Formula: C19H26N4O4 MolecularWeight: 374.43414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC(=O)N3CCCC3)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)CC(=O)N3CCCC3)C(=O)O

InChI

InChI=1S/C19H26N4O4/c1-14(24)20-15-4-5-17(16(12-15)19(26)27)22-10-8-21(9-11-22)13-18(25)23-6-2-3-7-23/h4-5,12H,2-3,6-11,13H2,1H3,(H,20,24)(H,26,27)