1-[(5S)-3-methyl-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[(5S)-3-methyl-5-oxidanyl-5-phenyl-4H-pyrazol-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[(5S)-5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[(5S)-5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl]-4-phenyl-1-butanone IUPAC Name: 1-[(5S)-5-hydroxy-3-methyl-5-phenyl-4H-pyrazol-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[(5S)-5-hydroxy-3-methyl-5-phenyl-2-pyrazolin-1-yl]-4-phenyl-butan-1-one Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CC=CC=C2)O)C(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CC1=NN([C@](C1)(C2=CC=CC=C2)O)C(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2/c1-16-15-20(24,18-12-6-3-7-13-18)22(21-16)19(23)14-8-11-17-9-4-2-5-10-17/h2-7,9-10,12-13,24H,8,11,14-15H2,1H3/t20-/m0/s1