2-[(4-bromanyl-2-methyl-phenyl)methyl]-3-propan-2-yl-1H-pyrazol-5-one

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)methyl]-3-propan-2-yl-1H-pyrazol-5-one Openeye Name: 2-[(4-bromo-2-methyl-phenyl)methyl]-3-isopropyl-1H-pyrazol-5-one CAS Name: 2-[(4-bromo-2-methylphenyl)methyl]-3-propan-2-yl-1H-pyrazol-5-one IUPAC Name: 2-[(4-bromo-2-methylphenyl)methyl]-3-propan-2-yl-1H-pyrazol-5-one Traditional Name: 1-(4-bromo-2-methyl-benzyl)-5-isopropyl-3-pyrazolin-3-one Formula: C14H17BrN2O MolecularWeight: 309.20158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)CN2C(=CC(=O)N2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)CN2C(=CC(=O)N2)C(C)C

InChI

InChI=1S/C14H17BrN2O/c1-9(2)13-7-14(18)16-17(13)8-11-4-5-12(15)6-10(11)3/h4-7,9H,8H2,1-3H3,(H,16,18)