[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-yl-phenyl)methanone

Systemtic Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-yl-phenyl)methanone Openeye Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-yl-phenyl)methanone CAS Name: [4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-[3-nitro-4-(1-pyrrolidinyl)phenyl]methanone IUPAC Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-(3-nitro-4-pyrrolidin-1-ylphenyl)methanone Traditional Name: [4-(4-chlorophenyl)sulfonylpiperazino]-(3-nitro-4-pyrrolidino-phenyl)methanone Formula: C21H23ClN4O5S MolecularWeight: 478.94912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O5S/c22-17-4-6-18(7-5-17)32(30,31)25-13-11-24(12-14-25)21(27)16-3-8-19(20(15-16)26(28)29)23-9-1-2-10-23/h3-8,15H,1-2,9-14H2