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

Systemtic Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylethyl]-2-nitro-benzamide Openeye Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylethyl]-2-nitro-benzamide CAS Name: N-[2-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]ethyl]-2-nitrobenzamide IUPAC Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylethyl]-2-nitrobenzamide Traditional Name: N-[2-[4-(4-methoxyphenyl)piperazino]sulfonylethyl]-2-nitro-benzamide Formula: C20H24N4O6S MolecularWeight: 448.49276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)S(=O)(=O)CCNC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6S/c1-30-17-8-6-16(7-9-17)22-11-13-23(14-12-22)31(28,29)15-10-21-20(25)18-4-2-3-5-19(18)24(26)27/h2-9H,10-15H2,1H3,(H,21,25)