2-[(E)-(4-methoxycarbonyl-1-oxidanylidene-isoquinolin-2-yl)iminomethyl]benzoic acid

Systemtic Name: 2-[(E)-(4-methoxycarbonyl-1-oxidanylidene-isoquinolin-2-yl)iminomethyl]benzoic acid Openeye Name: 2-[(E)-(4-methoxycarbonyl-1-oxo-2-isoquinolyl)iminomethyl]benzoic acid CAS Name: 2-[(E)-(4-methoxycarbonyl-1-oxo-2-isoquinolinyl)iminomethyl]benzoic acid IUPAC Name: 2-[(E)-(4-methoxycarbonyl-1-oxoisoquinolin-2-yl)iminomethyl]benzoic acid Traditional Name: 2-[(E)-(4-carbomethoxy-1-keto-2-isoquinolyl)iminomethyl]benzoic acid Formula: C19H14N2O5 MolecularWeight: 350.32486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)N=CC3=CC=CC=C3C(=O)O

Isomeric SMILES

COC(=O)C1=CN(C(=O)C2=CC=CC=C21)/N=C/C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H14N2O5/c1-26-19(25)16-11-21(17(22)15-9-5-4-8-14(15)16)20-10-12-6-2-3-7-13(12)18(23)24/h2-11H,1H3,(H,23,24)/b20-10+