4-[(4-nitrophenyl)amino]-N-(1,3,5-trimethylpyrazol-4-yl)butanamide

Systemtic Name: 4-[(4-nitrophenyl)amino]-N-(1,3,5-trimethylpyrazol-4-yl)butanamide Openeye Name: 4-(4-nitroanilino)-N-(1,3,5-trimethylpyrazol-4-yl)butanamide CAS Name: 4-(4-nitroanilino)-N-(1,3,5-trimethyl-4-pyrazolyl)butanamide IUPAC Name: 4-(4-nitroanilino)-N-(1,3,5-trimethylpyrazol-4-yl)butanamide Traditional Name: 4-(4-nitroanilino)-N-(1,3,5-trimethylpyrazol-4-yl)butyramide Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O3/c1-11-16(12(2)20(3)19-11)18-15(22)5-4-10-17-13-6-8-14(9-7-13)21(23)24/h6-9,17H,4-5,10H2,1-3H3,(H,18,22)