1,2,4-trimethyl-5-phenethyl-pyrazol-3-one

Systemtic Name: 1,2,4-trimethyl-5-phenethyl-pyrazol-3-one Openeye Name: 1,2,4-trimethyl-5-phenethyl-pyrazol-3-one CAS Name: 1,2,4-trimethyl-5-phenethyl-3-pyrazolone IUPAC Name: 1,2,4-trimethyl-5-phenethylpyrazol-3-one Traditional Name: 1,2,4-trimethyl-5-phenethyl-3-pyrazolin-3-one Formula: C14H18N2O MolecularWeight: 230.30552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N(C1=O)C)C)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(N(N(C1=O)C)C)CCC2=CC=CC=C2

InChI

InChI=1S/C14H18N2O/c1-11-13(15(2)16(3)14(11)17)10-9-12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3