4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(4-methoxyphenyl)methyl]butanamide

Systemtic Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(4-methoxyphenyl)methyl]butanamide Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[(4-methoxyphenyl)methyl]butanamide CAS Name: 4-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[(4-methoxyphenyl)methyl]butanamide IUPAC Name: 4-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[(4-methoxyphenyl)methyl]butanamide Traditional Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-p-anisyl-butyramide Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCC(=O)NCC2=CC=C(C=C2)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCCC(=O)NCC2=CC=C(C=C2)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O4/c1-12-17(21(23)24)13(2)20(19-12)10-4-5-16(22)18-11-14-6-8-15(25-3)9-7-14/h6-9H,4-5,10-11H2,1-3H3,(H,18,22)