4-bromanyl-2-(3-methylpiperidin-1-yl)benzoic acid

Systemtic Name: 4-bromanyl-2-(3-methylpiperidin-1-yl)benzoic acid Openeye Name: 4-bromo-2-(3-methyl-1-piperidyl)benzoic acid CAS Name: 4-bromo-2-(3-methyl-1-piperidinyl)benzoic acid IUPAC Name: 4-bromo-2-(3-methylpiperidin-1-yl)benzoic acid Traditional Name: 4-bromo-2-(3-methylpiperidino)benzoic acid Formula: C13H16BrNO2 MolecularWeight: 298.17564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=CC(=C2)Br)C(=O)O

Isomeric SMILES

CC1CCCN(C1)C2=C(C=CC(=C2)Br)C(=O)O

InChI

InChI=1S/C13H16BrNO2/c1-9-3-2-6-15(8-9)12-7-10(14)4-5-11(12)13(16)17/h4-5,7,9H,2-3,6,8H2,1H3,(H,16,17)