methyl 5-bromanyl-2-(piperidin-1-ylmethyl)benzoate

Systemtic Name: methyl 5-bromanyl-2-(piperidin-1-ylmethyl)benzoate Openeye Name: methyl 5-bromo-2-(1-piperidylmethyl)benzoate CAS Name: 5-bromo-2-(1-piperidinylmethyl)benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(piperidin-1-ylmethyl)benzoate Traditional Name: 5-bromo-2-(piperidinomethyl)benzoic acid methyl ester Formula: C14H18BrNO2 MolecularWeight: 312.20222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)CN2CCCCC2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)CN2CCCCC2

InChI

InChI=1S/C14H18BrNO2/c1-18-14(17)13-9-12(15)6-5-11(13)10-16-7-3-2-4-8-16/h5-6,9H,2-4,7-8,10H2,1H3