N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)sulfonylphenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-(4-ethylpiperazino)sulfonylphenyl]-2-methyl-3-nitro-benzamide Formula: C20H24N4O5S MolecularWeight: 432.49336

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H24N4O5S/c1-3-22-11-13-23(14-12-22)30(28,29)17-9-7-16(8-10-17)21-20(25)18-5-4-6-19(15(18)2)24(26)27/h4-10H,3,11-14H2,1-2H3,(H,21,25)