N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]-3,5-dinitro-benzamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]-3,5-dinitro-benzamide CAS Name: N-[4-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]-3,5-dinitrobenzamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]sulfonylphenyl]-3,5-dinitro-benzamide Formula: C24H23N5O8S MolecularWeight: 541.53312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C24H23N5O8S/c1-37-23-5-3-2-4-22(23)26-10-12-27(13-11-26)38(35,36)21-8-6-18(7-9-21)25-24(30)17-14-19(28(31)32)16-20(15-17)29(33)34/h2-9,14-16H,10-13H2,1H3,(H,25,30)