3-bromanyl-4-(4,4-dimethylpiperidin-1-yl)benzoic acid

Systemtic Name: 3-bromanyl-4-(4,4-dimethylpiperidin-1-yl)benzoic acid Openeye Name: 3-bromo-4-(4,4-dimethyl-1-piperidyl)benzoic acid CAS Name: 3-bromo-4-(4,4-dimethyl-1-piperidinyl)benzoic acid IUPAC Name: 3-bromo-4-(4,4-dimethylpiperidin-1-yl)benzoic acid Traditional Name: 3-bromo-4-(4,4-dimethylpiperidino)benzoic acid Formula: C14H18BrNO2 MolecularWeight: 312.20222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C2=C(C=C(C=C2)C(=O)O)Br)C

Isomeric SMILES

CC1(CCN(CC1)C2=C(C=C(C=C2)C(=O)O)Br)C

InChI

InChI=1S/C14H18BrNO2/c1-14(2)5-7-16(8-6-14)12-4-3-10(13(17)18)9-11(12)15/h3-4,9H,5-8H2,1-2H3,(H,17,18)