1-[3-[di(propan-2-yl)amino]-2-oxidanyl-propyl]-2,5-dimethyl-4-(phenylcarbonyl)pyrazol-3-one

Systemtic Name: 1-[3-[di(propan-2-yl)amino]-2-oxidanyl-propyl]-2,5-dimethyl-4-(phenylcarbonyl)pyrazol-3-one Openeye Name: 4-benzoyl-1-[3-(diisopropylamino)-2-hydroxy-propyl]-2,5-dimethyl-pyrazol-3-one CAS Name: 4-benzoyl-1-[3-[di(propan-2-yl)amino]-2-hydroxypropyl]-2,5-dimethyl-3-pyrazolone IUPAC Name: 4-benzoyl-1-[3-[di(propan-2-yl)amino]-2-hydroxypropyl]-2,5-dimethylpyrazol-3-one Traditional Name: 4-benzoyl-1-[3-(diisopropylamino)-2-hydroxy-propyl]-2,5-dimethyl-3-pyrazolin-3-one Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1CC(CN(C(C)C)C(C)C)O)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N(N1CC(CN(C(C)C)C(C)C)O)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H31N3O3/c1-14(2)23(15(3)4)12-18(25)13-24-16(5)19(21(27)22(24)6)20(26)17-10-8-7-9-11-17/h7-11,14-15,18,25H,12-13H2,1-6H3