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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)N2CCC(CC2)C(=O)O)Br

Isomeric SMILES

CCCN1C=C(C=C1C(=O)N2CCC(CC2)C(=O)O)Br

InChI

InChI=1S/C14H19BrN2O3/c1-2-5-17-9-11(15)8-12(17)13(18)16-6-3-10(4-7-16)14(19)20/h8-10H,2-7H2,1H3,(H,19,20)