1-[4-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine

Systemtic Name: 1-[4-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[4-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine CAS Name: 1-[4-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-3-nitrophenyl]sulfonyl-4-methylpiperazine IUPAC Name: 1-[4-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-3-nitrophenyl]sulfonyl-4-methylpiperazine Traditional Name: 1-[4-[4-(3-chlorobenzyl)piperazino]-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Formula: C22H28ClN5O4S MolecularWeight: 494.00682

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC(=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCN(CC3)CC4=CC(=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H28ClN5O4S/c1-24-7-13-27(14-8-24)33(31,32)20-5-6-21(22(16-20)28(29)30)26-11-9-25(10-12-26)17-18-3-2-4-19(23)15-18/h2-6,15-16H,7-14,17H2,1H3