N-cyclopropyl-4-nitro-N-[1-(phenylmethyl)piperidin-4-yl]benzenesulfonamide

Systemtic Name: N-cyclopropyl-4-nitro-N-[1-(phenylmethyl)piperidin-4-yl]benzenesulfonamide Openeye Name: N-(1-benzyl-4-piperidyl)-N-cyclopropyl-4-nitro-benzenesulfonamide CAS Name: N-cyclopropyl-4-nitro-N-[1-(phenylmethyl)-4-piperidinyl]benzenesulfonamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-N-cyclopropyl-4-nitrobenzenesulfonamide Traditional Name: N-(1-benzyl-4-piperidyl)-N-cyclopropyl-4-nitro-benzenesulfonamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1N(C2CCN(CC2)CC3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4S/c25-24(26)20-8-10-21(11-9-20)29(27,28)23(18-6-7-18)19-12-14-22(15-13-19)16-17-4-2-1-3-5-17/h1-5,8-11,18-19H,6-7,12-16H2