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

Systemtic Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[4-methoxy-3-(4-methylpiperazino)phenyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C19H24N4O5S MolecularWeight: 420.48266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N4O5S/c1-14-4-6-16(23(24)25)13-19(14)29(26,27)20-15-5-7-18(28-3)17(12-15)22-10-8-21(2)9-11-22/h4-7,12-13,20H,8-11H2,1-3H3