N-(2,3-dimethylphenyl)-2-[methyl-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)amino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[methyl-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)amino]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[N-methyl-2-nitro-4-(1-piperidylsulfonyl)anilino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[N-methyl-2-nitro-4-(1-piperidinylsulfonyl)anilino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-(N-methyl-2-nitro-4-piperidin-1-ylsulfonylanilino)acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-(N-methyl-2-nitro-4-piperidinosulfonyl-anilino)acetamide Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN(C)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN(C)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C22H28N4O5S/c1-16-8-7-9-19(17(16)2)23-22(27)15-24(3)20-11-10-18(14-21(20)26(28)29)32(30,31)25-12-5-4-6-13-25/h7-11,14H,4-6,12-13,15H2,1-3H3,(H,23,27)