[1-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperidin-3-yl]-morpholin-4-yl-methanone

Systemtic Name: [1-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperidin-3-yl]-morpholin-4-yl-methanone Openeye Name: [1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-3-piperidyl]-morpholino-methanone CAS Name: [1-(2,3-dimethyl-5-nitrophenyl)sulfonyl-3-piperidinyl]-(4-morpholinyl)methanone IUPAC Name: [1-(2,3-dimethyl-5-nitrophenyl)sulfonylpiperidin-3-yl]-morpholin-4-ylmethanone Traditional Name: [1-(2,3-dimethyl-5-nitro-phenyl)sulfonyl-3-piperidyl]-morpholino-methanone Formula: C18H25N3O6S MolecularWeight: 411.4726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O6S/c1-13-10-16(21(23)24)11-17(14(13)2)28(25,26)20-5-3-4-15(12-20)18(22)19-6-8-27-9-7-19/h10-11,15H,3-9,12H2,1-2H3