N-hexyl-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-hexyl-3-oxidanylidene-2-phenyl-1H-pyrazole-5-carboxamide Openeye Name: N-hexyl-3-oxo-2-phenyl-1H-pyrazole-5-carboxamide CAS Name: N-hexyl-3-oxo-2-phenyl-1H-pyrazole-5-carboxamide IUPAC Name: N-hexyl-3-oxo-2-phenyl-1H-pyrazole-5-carboxamide Traditional Name: N-hexyl-5-keto-1-phenyl-3-pyrazoline-3-carboxamide Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC(=O)N(N1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCNC(=O)C1=CC(=O)N(N1)C2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2/c1-2-3-4-8-11-17-16(21)14-12-15(20)19(18-14)13-9-6-5-7-10-13/h5-7,9-10,12,18H,2-4,8,11H2,1H3,(H,17,21)