2-(4-methoxyphenyl)-4-[C-methyl-N-(3-oxidanylpropyl)carbonimidoyl]-5-phenyl-4H-pyrazol-3-one

Systemtic Name: 2-(4-methoxyphenyl)-4-[C-methyl-N-(3-oxidanylpropyl)carbonimidoyl]-5-phenyl-4H-pyrazol-3-one Openeye Name: 4-[N-(3-hydroxypropyl)-C-methyl-carbonimidoyl]-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one CAS Name: 4-[1-(3-hydroxypropylimino)ethyl]-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one IUPAC Name: 4-[N-(3-hydroxypropyl)-C-methylcarbonimidoyl]-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one Traditional Name: 4-[N-(3-hydroxypropyl)-C-methyl-carbonimidoyl]-2-(4-methoxyphenyl)-5-phenyl-2-pyrazolin-3-one Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCCO)C1C(=NN(C1=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(=NCCCO)C1C(=NN(C1=O)C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O3/c1-15(22-13-6-14-25)19-20(16-7-4-3-5-8-16)23-24(21(19)26)17-9-11-18(27-2)12-10-17/h3-5,7-12,19,25H,6,13-14H2,1-2H3