4-(3-azanylpropyl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 4-(3-azanylpropyl)-2-phenyl-4H-pyrazol-3-one Openeye Name: 4-(3-aminopropyl)-2-phenyl-4H-pyrazol-3-one CAS Name: 4-(3-aminopropyl)-2-phenyl-4H-pyrazol-3-one IUPAC Name: 4-(3-aminopropyl)-2-phenyl-4H-pyrazol-3-one Traditional Name: 4-(3-aminopropyl)-2-phenyl-2-pyrazolin-3-one Formula: C12H15N3O MolecularWeight: 217.267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(C=N2)CCCN

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C(C=N2)CCCN

InChI

InChI=1S/C12H15N3O/c13-8-4-5-10-9-14-15(12(10)16)11-6-2-1-3-7-11/h1-3,6-7,9-10H,4-5,8,13H2