3-[[(4-bromophenyl)sulfonyl-phenyl-amino]methyl]piperidine-1-carboxylic acid

Systemtic Name: 3-[[(4-bromophenyl)sulfonyl-phenyl-amino]methyl]piperidine-1-carboxylic acid Openeye Name: 3-[(N-(4-bromophenyl)sulfonylanilino)methyl]piperidine-1-carboxylic acid CAS Name: 3-[(N-(4-bromophenyl)sulfonylanilino)methyl]-1-piperidinecarboxylic acid IUPAC Name: 3-[(N-(4-bromophenyl)sulfonylanilino)methyl]piperidine-1-carboxylic acid Traditional Name: 3-[(N-brosylanilino)methyl]piperidine-1-carboxylic acid Formula: C19H21BrN2O4S MolecularWeight: 453.35004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CC(CN(C1)C(=O)O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O4S/c20-16-8-10-18(11-9-16)27(25,26)22(17-6-2-1-3-7-17)14-15-5-4-12-21(13-15)19(23)24/h1-3,6-11,15H,4-5,12-14H2,(H,23,24)