N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-3-nitro-benzamide Openeye Name: N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-3-nitro-benzamide CAS Name: N-[2-[[4-(4-chlorophenyl)-1-piperazinyl]sulfonyl]ethyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-(4-chlorophenyl)piperazin-1-yl]sulfonylethyl]-3-nitrobenzamide Traditional Name: N-[2-[4-(4-chlorophenyl)piperazino]sulfonylethyl]-3-nitro-benzamide Formula: C19H21ClN4O5S MolecularWeight: 452.91184

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)S(=O)(=O)CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21ClN4O5S/c20-16-4-6-17(7-5-16)22-9-11-23(12-10-22)30(28,29)13-8-21-19(25)15-2-1-3-18(14-15)24(26)27/h1-7,14H,8-13H2,(H,21,25)