2-[(2-methyl-5-nitro-phenyl)amino]-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)amino]-N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(2-methyl-5-nitro-anilino)-N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(2-methyl-5-nitroanilino)-N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(2-methyl-5-nitroanilino)-N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(2-methyl-5-nitro-anilino)-N-(2-methyl-5-piperidinosulfonyl-phenyl)acetamide Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C21H26N4O5S/c1-15-6-8-17(25(27)28)12-19(15)22-14-21(26)23-20-13-18(9-7-16(20)2)31(29,30)24-10-4-3-5-11-24/h6-9,12-13,22H,3-5,10-11,14H2,1-2H3,(H,23,26)