2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-N-(2-propan-2-ylpyrazol-3-yl)ethanamide

Systemtic Name: 2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)-N-(2-propan-2-ylpyrazol-3-yl)ethanamide Openeye Name: N-(2-isopropylpyrazol-3-yl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide CAS Name: 2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]-N-(2-propan-2-yl-3-pyrazolyl)acetamide IUPAC Name: 2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)-N-(2-propan-2-ylpyrazol-3-yl)acetamide Traditional Name: N-(2-isopropylpyrazol-3-yl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)acetamide Formula: C18H23N5O7S MolecularWeight: 453.46952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N5O7S/c1-13(2)22-17(5-6-19-22)20-18(24)12-30-16-4-3-14(11-15(16)23(25)26)31(27,28)21-7-9-29-10-8-21/h3-6,11,13H,7-10,12H2,1-2H3,(H,20,24)