1-[3-(5-bromanylindol-1-yl)propanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(5-bromanylindol-1-yl)propanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-(5-bromoindol-1-yl)propanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-(5-bromo-1-indolyl)-1-oxopropyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(5-bromoindol-1-yl)propanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-(5-bromoindol-1-yl)propanoyl]isonipecotic acid Formula: C17H19BrN2O3 MolecularWeight: 379.24836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CCN2C=CC3=C2C=CC(=C3)Br

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CCN2C=CC3=C2C=CC(=C3)Br

InChI

InChI=1S/C17H19BrN2O3/c18-14-1-2-15-13(11-14)5-7-19(15)10-6-16(21)20-8-3-12(4-9-20)17(22)23/h1-2,5,7,11-12H,3-4,6,8-10H2,(H,22,23)