4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-quinolin-8-ylethyl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-quinolin-8-ylethyl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(8-quinolyl)ethyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[2-(8-quinolinyl)ethyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(2-quinolin-8-ylethyl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(8-quinolyl)ethyl]benzamide Formula: C24H23N5O3 MolecularWeight: 429.47112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCCC3=CC=CC4=C3N=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCCC3=CC=CC4=C3N=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C24H23N5O3/c1-16-23(29(31)32)17(2)28(27-16)15-18-8-10-21(11-9-18)24(30)26-14-12-20-6-3-5-19-7-4-13-25-22(19)20/h3-11,13H,12,14-15H2,1-2H3,(H,26,30)