ethyl (2E)-2-(2-methylisoquinolin-1-ylidene)-3-oxidanylidene-3-phenyl-propanoate

Systemtic Name: ethyl (2E)-2-(2-methylisoquinolin-1-ylidene)-3-oxidanylidene-3-phenyl-propanoate Openeye Name: ethyl (2E)-2-(2-methyl-1-isoquinolylidene)-3-oxo-3-phenyl-propanoate CAS Name: (2E)-2-(2-methyl-1-isoquinolinylidene)-3-oxo-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-(2-methylisoquinolin-1-ylidene)-3-oxo-3-phenylpropanoate Traditional Name: (2E)-3-keto-2-(2-methyl-1-isoquinolylidene)-3-phenyl-propionic acid ethyl ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C2=CC=CC=C2C=CN1C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C(=C/1\C2=CC=CC=C2C=CN1C)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19NO3/c1-3-25-21(24)18(20(23)16-10-5-4-6-11-16)19-17-12-8-7-9-15(17)13-14-22(19)2/h4-14H,3H2,1-2H3/b19-18+