N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-oxidanyl-propoxy]phenyl]ethanamide

Systemtic Name: N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-oxidanyl-propoxy]phenyl]ethanamide Openeye Name: N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-hydroxy-propoxy]phenyl]acetamide CAS Name: N-[4-[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-2-hydroxypropoxy]phenyl]acetamide IUPAC Name: N-[4-[3-(3,5-dimethyl-4-nitropyrazol-1-yl)-2-hydroxypropoxy]phenyl]acetamide Traditional Name: N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-2-hydroxy-propoxy]phenyl]acetamide Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(COC2=CC=C(C=C2)NC(=O)C)O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(COC2=CC=C(C=C2)NC(=O)C)O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O5/c1-10-16(20(23)24)11(2)19(18-10)8-14(22)9-25-15-6-4-13(5-7-15)17-12(3)21/h4-7,14,22H,8-9H2,1-3H3,(H,17,21)