ethyl 4-[(4Z)-1,3-bis(oxidanylidene)-4-(pyridin-4-ylmethylidene)isoquinolin-2-yl]benzoate

Systemtic Name: ethyl 4-[(4Z)-1,3-bis(oxidanylidene)-4-(pyridin-4-ylmethylidene)isoquinolin-2-yl]benzoate Openeye Name: ethyl 4-[(4Z)-1,3-dioxo-4-(4-pyridylmethylene)-2-isoquinolyl]benzoate CAS Name: 4-[(4Z)-1,3-dioxo-4-(pyridin-4-ylmethylidene)-2-isoquinolinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4Z)-1,3-dioxo-4-(pyridin-4-ylmethylidene)isoquinolin-2-yl]benzoate Traditional Name: 4-[(4Z)-1,3-diketo-4-(4-pyridylmethylene)-2-isoquinolyl]benzoic acid ethyl ester Formula: C24H18N2O4 MolecularWeight: 398.41072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CC4=CC=NC=C4)C2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3/C(=C/C4=CC=NC=C4)/C2=O

InChI

InChI=1S/C24H18N2O4/c1-2-30-24(29)17-7-9-18(10-8-17)26-22(27)20-6-4-3-5-19(20)21(23(26)28)15-16-11-13-25-14-12-16/h3-15H,2H2,1H3/b21-15-