2-[2-[4-(5-methyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[4-(5-methyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[4-(2-hydroxy-5-methyl-benzoyl)pyrazol-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[4-[(2-hydroxy-5-methylphenyl)-oxomethyl]-1-pyrazolyl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[4-(2-hydroxy-5-methylbenzoyl)pyrazol-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-[4-(2-hydroxy-5-methyl-benzoyl)pyrazol-1-yl]-2-keto-ethoxy]benzonitrile Formula: C20H15N3O4 MolecularWeight: 361.3508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)C2=CN(N=C2)C(=O)COC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)C2=CN(N=C2)C(=O)COC3=CC=CC=C3C#N

InChI

InChI=1S/C20H15N3O4/c1-13-6-7-17(24)16(8-13)20(26)15-10-22-23(11-15)19(25)12-27-18-5-3-2-4-14(18)9-21/h2-8,10-11,24H,12H2,1H3