N-(1-methylsulfonylpiperidin-4-yl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-4-(3-nitrophenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-4-(3-nitrophenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(1-mesyl-4-piperidyl)-4-(3-nitrophenyl)sulfonyl-piperazine-1-carboxamide Formula: C17H25N5O7S2 MolecularWeight: 475.5397

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N5O7S2/c1-30(26,27)20-7-5-14(6-8-20)18-17(23)19-9-11-21(12-10-19)31(28,29)16-4-2-3-15(13-16)22(24)25/h2-4,13-14H,5-12H2,1H3,(H,18,23)