methyl (E)-3-isoquinolin-4-ylprop-2-enoate

Systemtic Name: methyl (E)-3-isoquinolin-4-ylprop-2-enoate Openeye Name: methyl (E)-3-(4-isoquinolyl)prop-2-enoate CAS Name: (E)-3-(4-isoquinolinyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-isoquinolin-4-ylprop-2-enoate Traditional Name: (E)-3-(4-isoquinolyl)acrylic acid methyl ester Formula: C13H11NO2 MolecularWeight: 213.23194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC1=CN=CC2=CC=CC=C21

Isomeric SMILES

COC(=O)/C=C/C1=CN=CC2=CC=CC=C21

InChI

InChI=1S/C13H11NO2/c1-16-13(15)7-6-11-9-14-8-10-4-2-3-5-12(10)11/h2-9H,1H3/b7-6+