4-[3-(methylamino)propyl]-5-phenyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[3-(methylamino)propyl]-5-phenyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[3-(methylamino)propyl]-5-phenyl-1,2-dihydropyrazol-3-one CAS Name: 4-[3-(methylamino)propyl]-5-phenyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[3-(methylamino)propyl]-5-phenyl-1,2-dihydropyrazol-3-one Traditional Name: 4-[3-(methylamino)propyl]-5-phenyl-3-pyrazolin-3-one Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCC1=C(NNC1=O)C2=CC=CC=C2

Isomeric SMILES

CNCCCC1=C(NNC1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H17N3O/c1-14-9-5-8-11-12(15-16-13(11)17)10-6-3-2-4-7-10/h2-4,6-7,14H,5,8-9H2,1H3,(H2,15,16,17)