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

Systemtic Name: 4-azanyl-1-methyl-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: 4-amino-1-methyl-2-phenyl-5-propyl-pyrazol-3-one CAS Name: 4-amino-1-methyl-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: 4-amino-1-methyl-2-phenyl-5-propylpyrazol-3-one Traditional Name: 4-amino-1-methyl-2-phenyl-5-propyl-3-pyrazolin-3-one Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O/c1-3-7-11-12(14)13(17)16(15(11)2)10-8-5-4-6-9-10/h4-6,8-9H,3,7,14H2,1-2H3