4-[[2-(phenoxymethyl)phenyl]methyl]-5-propan-2-yl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[[2-(phenoxymethyl)phenyl]methyl]-5-propan-2-yl-1,2-dihydropyrazol-3-one Openeye Name: 5-isopropyl-4-[[2-(phenoxymethyl)phenyl]methyl]-1,2-dihydropyrazol-3-one CAS Name: 4-[[2-(phenoxymethyl)phenyl]methyl]-5-propan-2-yl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[[2-(phenoxymethyl)phenyl]methyl]-5-propan-2-yl-1,2-dihydropyrazol-3-one Traditional Name: 5-isopropyl-4-[2-(phenoxymethyl)benzyl]-3-pyrazolin-3-one Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)NN1)CC2=CC=CC=C2COC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C(=O)NN1)CC2=CC=CC=C2COC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2/c1-14(2)19-18(20(23)22-21-19)12-15-8-6-7-9-16(15)13-24-17-10-4-3-5-11-17/h3-11,14H,12-13H2,1-2H3,(H2,21,22,23)