1-[3-[2-(dioxidanyl)phenyl]-5-(naphthalen-2-ylamino)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[3-[2-(dioxidanyl)phenyl]-5-(naphthalen-2-ylamino)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[3-(2-hydroperoxyphenyl)-5-(2-naphthylamino)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[3-(2-hydroperoxyphenyl)-5-(2-naphthalenylamino)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[3-(2-hydroperoxyphenyl)-5-(naphthalen-2-ylamino)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[5-(2-hydroperoxyphenyl)-3-(2-naphthylamino)-2-pyrazolin-1-yl]ethanone Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(CC(=N1)NC2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4OO

Isomeric SMILES

CC(=O)N1C(CC(=N1)NC2=CC3=CC=CC=C3C=C2)C4=CC=CC=C4OO

InChI

InChI=1S/C21H19N3O3/c1-14(25)24-19(18-8-4-5-9-20(18)27-26)13-21(23-24)22-17-11-10-15-6-2-3-7-16(15)12-17/h2-12,19,26H,13H2,1H3,(H,22,23)