N-(2-methoxyphenyl)-4-(3-methylpiperazin-1-yl)-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-4-(3-methylpiperazin-1-yl)-3-nitro-benzenesulfonamide Openeye Name: N-(2-methoxyphenyl)-4-(3-methylpiperazin-1-yl)-3-nitro-benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-4-(3-methyl-1-piperazinyl)-3-nitrobenzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-4-(3-methylpiperazin-1-yl)-3-nitrobenzenesulfonamide Traditional Name: N-(2-methoxyphenyl)-4-(3-methylpiperazino)-3-nitro-benzenesulfonamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

CC1CN(CCN1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S/c1-13-12-21(10-9-19-13)16-8-7-14(11-17(16)22(23)24)28(25,26)20-15-5-3-4-6-18(15)27-2/h3-8,11,13,19-20H,9-10,12H2,1-2H3