N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2,3-dipentyl-benzamide

Systemtic Name: N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)-2,3-dipentyl-benzamide Openeye Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2,3-dipentyl-benzamide CAS Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2,3-dipentylbenzamide IUPAC Name: N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-2,3-dipentylbenzamide Traditional Name: 2,3-diamyl-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)benzamide Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC(=C1CCCCC)C(=O)NC2=CC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

CCCCCC1=CC=CC(=C1CCCCC)C(=O)NC2=CC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C26H33N3O2/c1-3-5-8-13-20-14-12-18-23(22(20)17-9-6-4-2)26(31)27-24-19-25(30)29(28-24)21-15-10-7-11-16-21/h7,10-12,14-16,18-19,28H,3-6,8-9,13,17H2,1-2H3,(H,27,31)