[1-(2-nitrophenyl)sulfonylpiperidin-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [1-(2-nitrophenyl)sulfonylpiperidin-3-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(2-nitrophenyl)sulfonyl-3-piperidyl]methanone CAS Name: [1-(2-nitrophenyl)sulfonyl-3-piperidinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-(2-nitrophenyl)sulfonylpiperidin-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(2-nitrophenyl)sulfonyl-3-piperidyl]methanone Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O5S/c28-23(25-15-13-24(14-16-25)17-19-7-2-1-3-8-19)20-9-6-12-26(18-20)33(31,32)22-11-5-4-10-21(22)27(29)30/h1-5,7-8,10-11,20H,6,9,12-18H2