N-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-phenyl]methanesulfonamide

Systemtic Name: N-[2-methyl-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-phenyl]methanesulfonamide Openeye Name: N-[2-methyl-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]methanesulfonamide CAS Name: N-[2-methyl-5-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]methanesulfonamide IUPAC Name: N-[2-methyl-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]methanesulfonamide Traditional Name: N-[2-methyl-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]methanesulfonamide Formula: C19H22N4O5S MolecularWeight: 418.46678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])NS(=O)(=O)C

InChI

InChI=1S/C19H22N4O5S/c1-14-3-4-15(13-18(14)20-29(2,27)28)19(24)22-11-9-21(10-12-22)16-5-7-17(8-6-16)23(25)26/h3-8,13,20H,9-12H2,1-2H3