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1-[3-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenoxy]phenyl]ethanone
1-[3-[4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-phenoxy]phenyl]ethanone
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)C1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]
Isomeric SMILES
CC(=O)C1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-]
InChI
InChI=1S/C19H21N3O6S/c1-14(23)15-4-3-5-16(12-15)28-19-7-6-17(13-18(19)22(24)25)29(26,27)21-10-8-20(2)9-11-21/h3-7,12-13H,8-11H2,1-2H3
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