5-methyl-1-phenyl-2-[(4-propan-2-yloxyphenyl)methyl]pyrazol-3-one

Systemtic Name: 5-methyl-1-phenyl-2-[(4-propan-2-yloxyphenyl)methyl]pyrazol-3-one Openeye Name: 2-[(4-isopropoxyphenyl)methyl]-5-methyl-1-phenyl-pyrazol-3-one CAS Name: 5-methyl-1-phenyl-2-[(4-propan-2-yloxyphenyl)methyl]-3-pyrazolone IUPAC Name: 5-methyl-1-phenyl-2-[(4-propan-2-yloxyphenyl)methyl]pyrazol-3-one Traditional Name: 2-(4-isopropoxybenzyl)-5-methyl-1-phenyl-3-pyrazolin-3-one Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1C2=CC=CC=C2)CC3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CC1=CC(=O)N(N1C2=CC=CC=C2)CC3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C20H22N2O2/c1-15(2)24-19-11-9-17(10-12-19)14-21-20(23)13-16(3)22(21)18-7-5-4-6-8-18/h4-13,15H,14H2,1-3H3