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

Systemtic Name: 4-azanyl-2-(3-chloranyl-4-methyl-phenyl)-1-methyl-5-propyl-pyrazol-3-one Openeye Name: 4-amino-2-(3-chloro-4-methyl-phenyl)-1-methyl-5-propyl-pyrazol-3-one CAS Name: 4-amino-2-(3-chloro-4-methylphenyl)-1-methyl-5-propyl-3-pyrazolone IUPAC Name: 4-amino-2-(3-chloro-4-methylphenyl)-1-methyl-5-propylpyrazol-3-one Traditional Name: 4-amino-2-(3-chloro-4-methyl-phenyl)-1-methyl-5-propyl-3-pyrazolin-3-one Formula: C14H18ClN3O MolecularWeight: 279.76522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClN3O/c1-4-5-12-13(16)14(19)18(17(12)3)10-7-6-9(2)11(15)8-10/h6-8H,4-5,16H2,1-3H3