4-methyl-N-[3-[methyl-[(phenylmethyl)amino]phosphoryl]oxypropyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-[methyl-[(phenylmethyl)amino]phosphoryl]oxypropyl]benzenesulfonamide Openeye Name: N-[3-[(benzylamino)-methyl-phosphoryl]oxypropyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[3-[methyl-[(phenylmethyl)amino]phosphoryl]oxypropyl]benzenesulfonamide IUPAC Name: N-[3-[(benzylamino)-methylphosphoryl]oxypropyl]-4-methylbenzenesulfonamide Traditional Name: N-[3-[(benzylamino)-methyl-phosphoryl]oxypropyl]-4-methyl-benzenesulfonamide Formula: C18H25N2O4PS MolecularWeight: 396.440861

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCOP(=O)(C)NCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCOP(=O)(C)NCC2=CC=CC=C2

InChI

InChI=1S/C18H25N2O4PS/c1-16-9-11-18(12-10-16)26(22,23)20-13-6-14-24-25(2,21)19-15-17-7-4-3-5-8-17/h3-5,7-12,20H,6,13-15H2,1-2H3,(H,19,21)