N-cyclopropyl-2-nitro-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]aniline

Systemtic Name: N-cyclopropyl-2-nitro-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]aniline Openeye Name: N-cyclopropyl-2-nitro-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]aniline CAS Name: N-cyclopropyl-2-nitro-5-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]aniline IUPAC Name: N-cyclopropyl-2-nitro-5-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]aniline Traditional Name: cyclopropyl-[5-(4-mesitylsulfonylpiperazino)-2-nitro-phenyl]amine Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC4CC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NC4CC4)C

InChI

InChI=1S/C22H28N4O4S/c1-15-12-16(2)22(17(3)13-15)31(29,30)25-10-8-24(9-11-25)19-6-7-21(26(27)28)20(14-19)23-18-4-5-18/h6-7,12-14,18,23H,4-5,8-11H2,1-3H3