2-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-nitro-phenyl]amino]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-nitro-phenyl]amino]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]-2-nitro-anilino]-N,N-dimethyl-acetamide CAS Name: 2-[4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]-2-nitroanilino]-N,N-dimethylacetamide IUPAC Name: 2-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonyl-2-nitroanilino]-N,N-dimethylacetamide Traditional Name: 2-[4-[(3R,5R)-3,5-dimethylpiperidino]sulfonyl-2-nitro-anilino]-N,N-dimethyl-acetamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC(=O)N(C)C)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC(=O)N(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H26N4O5S/c1-12-7-13(2)11-20(10-12)27(25,26)14-5-6-15(16(8-14)21(23)24)18-9-17(22)19(3)4/h5-6,8,12-13,18H,7,9-11H2,1-4H3/t12-,13-/m1/s1