1-(4-chloranyl-1-propan-2-yl-pyrrol-2-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-chloranyl-1-propan-2-yl-pyrrol-2-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(4-chloro-1-isopropyl-pyrrole-2-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[(4-chloro-1-propan-2-yl-2-pyrrolyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4-chloro-1-propan-2-ylpyrrole-2-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(4-chloro-1-isopropyl-pyrrole-2-carbonyl)isonipecotic acid Formula: C14H19ClN2O3 MolecularWeight: 298.76526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)N2CCC(CC2)C(=O)O)Cl

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)N2CCC(CC2)C(=O)O)Cl

InChI

InChI=1S/C14H19ClN2O3/c1-9(2)17-8-11(15)7-12(17)13(18)16-5-3-10(4-6-16)14(19)20/h7-10H,3-6H2,1-2H3,(H,19,20)