N-[1-(3-bromophenyl)ethyl]-1-methylsulfonyl-piperidin-4-amine

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-1-methylsulfonyl-piperidin-4-amine Openeye Name: N-[1-(3-bromophenyl)ethyl]-1-methylsulfonyl-piperidin-4-amine CAS Name: N-[1-(3-bromophenyl)ethyl]-1-methylsulfonyl-4-piperidinamine IUPAC Name: N-[1-(3-bromophenyl)ethyl]-1-methylsulfonylpiperidin-4-amine Traditional Name: 1-(3-bromophenyl)ethyl-(1-mesyl-4-piperidyl)amine Formula: C14H21BrN2O2S MolecularWeight: 361.29774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C14H21BrN2O2S/c1-11(12-4-3-5-13(15)10-12)16-14-6-8-17(9-7-14)20(2,18)19/h3-5,10-11,14,16H,6-9H2,1-2H3