ethyl (2Z)-3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxyimino-4-oxidanylidene-octanoate

Systemtic Name: ethyl (2Z)-3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxyimino-4-oxidanylidene-octanoate Openeye Name: ethyl (2Z)-3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxyimino-4-oxo-octanoate CAS Name: (2Z)-3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxyimino-4-oxooctanoic acid ethyl ester IUPAC Name: ethyl (2Z)-3-[[4-(2-cyanophenyl)phenyl]methyl]-2-methoxyimino-4-oxooctanoate Traditional Name: (2Z)-3-[4-(2-cyanophenyl)benzyl]-4-keto-2-methyloximino-caprylic acid ethyl ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)C(=NOC)C(=O)OCC

Isomeric SMILES

CCCCC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)/C(=N/OC)/C(=O)OCC

InChI

InChI=1S/C25H28N2O4/c1-4-6-11-23(28)22(24(27-30-3)25(29)31-5-2)16-18-12-14-19(15-13-18)21-10-8-7-9-20(21)17-26/h7-10,12-15,22H,4-6,11,16H2,1-3H3/b27-24-