N-(2-chloranyl-5-nitro-phenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-chloro-5-nitro-phenyl)benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-(2-chloro-5-nitrophenyl)benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(2-chloro-5-nitrophenyl)benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-(2-chloro-5-nitro-phenyl)benzamide Formula: C24H23ClN4O5S MolecularWeight: 514.98122

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H23ClN4O5S/c25-22-10-9-20(29(31)32)16-23(22)26-24(30)19-6-4-5-18(15-19)17-27-11-13-28(14-12-27)35(33,34)21-7-2-1-3-8-21/h1-10,15-16H,11-14,17H2,(H,26,30)