2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(phenylmethyl)carbamoyl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(phenylmethyl)carbamoyl]ethanamide Openeye Name: N-(benzylcarbamoyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[oxo-[(phenylmethyl)amino]methyl]acetamide IUPAC Name: N-(benzylcarbamoyl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-(benzylcarbamoyl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide Formula: C15H17N5O4 MolecularWeight: 331.32658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC(=O)NCC2=CC=CC=C2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC(=O)NCC2=CC=CC=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O4/c1-10-14(20(23)24)11(2)19(18-10)9-13(21)17-15(22)16-8-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H2,16,17,21,22)