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

Systemtic Name: 1-(4-bromanyl-1-propyl-pyrrol-2-yl)carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(4-bromo-1-propyl-pyrrole-2-carbonyl)piperidine-3-carboxylic acid CAS Name: 1-[(4-bromo-1-propyl-2-pyrrolyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(4-bromo-1-propylpyrrole-2-carbonyl)piperidine-3-carboxylic acid Traditional Name: 1-(4-bromo-1-propyl-pyrrole-2-carbonyl)nipecotic acid Formula: C14H19BrN2O3 MolecularWeight: 343.21626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)N2CCCC(C2)C(=O)O)Br

Isomeric SMILES

CCCN1C=C(C=C1C(=O)N2CCCC(C2)C(=O)O)Br

InChI

InChI=1S/C14H19BrN2O3/c1-2-5-16-9-11(15)7-12(16)13(18)17-6-3-4-10(8-17)14(19)20/h7,9-10H,2-6,8H2,1H3,(H,19,20)