4-azanyl-1-methyl-2-(3-methylphenyl)-5-propyl-pyrazol-3-one

Systemtic Name: 4-azanyl-1-methyl-2-(3-methylphenyl)-5-propyl-pyrazol-3-one Openeye Name: 4-amino-1-methyl-2-(m-tolyl)-5-propyl-pyrazol-3-one CAS Name: 4-amino-1-methyl-2-(3-methylphenyl)-5-propyl-3-pyrazolone IUPAC Name: 4-amino-1-methyl-2-(3-methylphenyl)-5-propylpyrazol-3-one Traditional Name: 4-amino-1-methyl-2-(m-tolyl)-5-propyl-3-pyrazolin-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)N(N1C)C2=CC=CC(=C2)C)N

Isomeric SMILES

CCCC1=C(C(=O)N(N1C)C2=CC=CC(=C2)C)N

InChI

InChI=1S/C14H19N3O/c1-4-6-12-13(15)14(18)17(16(12)3)11-8-5-7-10(2)9-11/h5,7-9H,4,6,15H2,1-3H3