(4R)-4-(4-bromophenyl)carbonyl-2-hexyl-5-methyl-4H-pyrazol-3-one

Systemtic Name: (4R)-4-(4-bromophenyl)carbonyl-2-hexyl-5-methyl-4H-pyrazol-3-one Openeye Name: (4R)-4-(4-bromobenzoyl)-2-hexyl-5-methyl-4H-pyrazol-3-one CAS Name: (4R)-4-[(4-bromophenyl)-oxomethyl]-2-hexyl-5-methyl-4H-pyrazol-3-one IUPAC Name: (4R)-4-(4-bromobenzoyl)-2-hexyl-5-methyl-4H-pyrazol-3-one Traditional Name: (4R)-4-(4-bromobenzoyl)-2-hexyl-5-methyl-2-pyrazolin-3-one Formula: C17H21BrN2O2 MolecularWeight: 365.26484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(C(=N1)C)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCCN1C(=O)[C@H](C(=N1)C)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H21BrN2O2/c1-3-4-5-6-11-20-17(22)15(12(2)19-20)16(21)13-7-9-14(18)10-8-13/h7-10,15H,3-6,11H2,1-2H3/t15-/m1/s1