4-chloranyl-N-[4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butyl]benzamide Openeye Name: 4-chloro-N-[4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxo-butyl]benzamide CAS Name: 4-chloro-N-[4-[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-4-oxobutyl]benzamide IUPAC Name: 4-chloro-N-[4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxobutyl]benzamide Traditional Name: 4-chloro-N-[4-keto-4-(4-nosylpiperazino)butyl]benzamide Formula: C21H23ClN4O6S MolecularWeight: 494.94852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCNC(=O)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CCCNC(=O)C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O6S/c22-17-5-3-16(4-6-17)21(28)23-11-1-2-20(27)24-12-14-25(15-13-24)33(31,32)19-9-7-18(8-10-19)26(29)30/h3-10H,1-2,11-15H2,(H,23,28)