3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-phenylpropyl)propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-phenylpropyl)propanamide Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-phenylpropyl)propanamide CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-(1-phenylpropyl)propanamide IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-(1-phenylpropyl)propanamide Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-phenylpropyl)propionamide Formula: C17H22N4O3 MolecularWeight: 330.38158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)NC(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CCC(C1=CC=CC=C1)NC(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C17H22N4O3/c1-4-15(14-8-6-5-7-9-14)18-16(22)10-11-20-13(3)17(21(23)24)12(2)19-20/h5-9,15H,4,10-11H2,1-3H3,(H,18,22)