ethyl 2-[(3-cyanophenyl)methyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(3-cyanophenyl)methyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(3-cyanophenyl)methyl]-3-oxo-butanoate CAS Name: 2-[(3-cyanophenyl)methyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(3-cyanophenyl)methyl]-3-oxobutanoate Traditional Name: 2-(3-cyanobenzyl)-3-keto-butyric acid ethyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC(=C1)C#N)C(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC(=C1)C#N)C(=O)C

InChI

InChI=1S/C14H15NO3/c1-3-18-14(17)13(10(2)16)8-11-5-4-6-12(7-11)9-15/h4-7,13H,3,8H2,1-2H3