[4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[2-nitro-4-(1-piperidylsulfonyl)phenyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(2-nitro-4-piperidin-1-ylsulfonylphenyl)piperazin-1-yl]-phenylmethanone Traditional Name: [4-(2-nitro-4-piperidinosulfonyl-phenyl)piperazino]-phenyl-methanone Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5S/c27-22(18-7-3-1-4-8-18)24-15-13-23(14-16-24)20-10-9-19(17-21(20)26(28)29)32(30,31)25-11-5-2-6-12-25/h1,3-4,7-10,17H,2,5-6,11-16H2