N,N-dimethyl-4-[1-(2-nitrophenyl)piperidin-4-yl]carbonyl-piperazine-1-sulfonamide

Systemtic Name: N,N-dimethyl-4-[1-(2-nitrophenyl)piperidin-4-yl]carbonyl-piperazine-1-sulfonamide Openeye Name: N,N-dimethyl-4-[1-(2-nitrophenyl)piperidine-4-carbonyl]piperazine-1-sulfonamide CAS Name: N,N-dimethyl-4-[[1-(2-nitrophenyl)-4-piperidinyl]-oxomethyl]-1-piperazinesulfonamide IUPAC Name: N,N-dimethyl-4-[1-(2-nitrophenyl)piperidine-4-carbonyl]piperazine-1-sulfonamide Traditional Name: N,N-dimethyl-4-[1-(2-nitrophenyl)isonipecotoyl]piperazine-1-sulfonamide Formula: C18H27N5O5S MolecularWeight: 425.50248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H27N5O5S/c1-19(2)29(27,28)22-13-11-21(12-14-22)18(24)15-7-9-20(10-8-15)16-5-3-4-6-17(16)23(25)26/h3-6,15H,7-14H2,1-2H3