4-chloranyl-N-[1-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[1-benzyl-2-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-2-oxo-ethyl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[1-[4-(3-cyclopentyl-1-oxopropyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[1-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-benzyl-2-[4-(3-cyclopentylpropanoyl)piperazino]-2-keto-ethyl]-4-chloro-3-nitro-benzenesulfonamide Formula: C27H33ClN4O6S MolecularWeight: 577.09212

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)C(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H33ClN4O6S/c28-23-12-11-22(19-25(23)32(35)36)39(37,38)29-24(18-21-8-2-1-3-9-21)27(34)31-16-14-30(15-17-31)26(33)13-10-20-6-4-5-7-20/h1-3,8-9,11-12,19-20,24,29H,4-7,10,13-18H2