[(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium

Systemtic Name: [(2R)-1-oxidanylidene-1-[(phenylmethyl)amino]propan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium Openeye Name: [(1R)-2-(benzylamino)-1-methyl-2-oxo-ethyl]-[(4-sulfamoylphenyl)methyl]ammonium CAS Name: [(2R)-1-oxo-1-[(phenylmethyl)amino]propan-2-yl]-[(4-sulfamoylphenyl)methyl]ammonium IUPAC Name: [(2R)-1-(benzylamino)-1-oxopropan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium Traditional Name: [(1R)-2-(benzylamino)-2-keto-1-methyl-ethyl]-(4-sulfamoylbenzyl)ammonium Formula: C17H22N3O3S+ MolecularWeight: 348.43988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[NH2+]CC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)[NH2+]CC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H21N3O3S/c1-13(17(21)20-12-14-5-3-2-4-6-14)19-11-15-7-9-16(10-8-15)24(18,22)23/h2-10,13,19H,11-12H2,1H3,(H,20,21)(H2,18,22,23)/p+1/t13-/m1/s1