N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonyl-phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[2-methoxy-5-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[2-methoxy-5-(4-methylpiperazino)sulfonyl-phenyl]-4-methyl-3-nitro-benzamide Formula: C20H24N4O6S MolecularWeight: 448.49276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6S/c1-14-4-5-15(12-18(14)24(26)27)20(25)21-17-13-16(6-7-19(17)30-3)31(28,29)23-10-8-22(2)9-11-23/h4-7,12-13H,8-11H2,1-3H3,(H,21,25)