1-(3-acetamido-1-propyl-pyrrol-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(3-acetamido-1-propyl-pyrrol-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(3-acetamido-1-propyl-pyrrole-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(3-acetamido-1-propyl-2-pyrrolyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(3-acetamido-1-propylpyrrole-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(3-acetamido-1-propyl-pyrrole-2-carbonyl)isonipecotic acid Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC(=C1C(=O)N2CCC(CC2)C(=O)O)NC(=O)C

Isomeric SMILES

CCCN1C=CC(=C1C(=O)N2CCC(CC2)C(=O)O)NC(=O)C

InChI

InChI=1S/C16H23N3O4/c1-3-7-18-10-6-13(17-11(2)20)14(18)15(21)19-8-4-12(5-9-19)16(22)23/h6,10,12H,3-5,7-9H2,1-2H3,(H,17,20)(H,22,23)