2-(4-nitroimidazol-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-(4-nitroimidazol-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]-2-(4-nitroimidazol-1-yl)acetamide CAS Name: 2-(4-nitro-1-imidazolyl)-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-(4-nitroimidazol-1-yl)-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)-2-(4-nitroimidazol-1-yl)acetamide Formula: C19H25N5O6S MolecularWeight: 451.4967

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H25N5O6S/c1-14(2)30-17-7-6-15(31(28,29)23-8-4-3-5-9-23)10-16(17)21-19(25)12-22-11-18(20-13-22)24(26)27/h6-7,10-11,13-14H,3-5,8-9,12H2,1-2H3,(H,21,25)