4-(6,7-dimethoxy-3-oxidanylidene-1,4-dihydroisoquinolin-2-yl)benzoate

Systemtic Name: 4-(6,7-dimethoxy-3-oxidanylidene-1,4-dihydroisoquinolin-2-yl)benzoate Openeye Name: 4-(6,7-dimethoxy-3-oxo-1,4-dihydroisoquinolin-2-yl)benzoate CAS Name: 4-(6,7-dimethoxy-3-oxo-1,4-dihydroisoquinolin-2-yl)benzoate IUPAC Name: 4-(6,7-dimethoxy-3-oxo-1,4-dihydroisoquinolin-2-yl)benzoate Traditional Name: 4-(3-keto-6,7-dimethoxy-1,4-dihydroisoquinolin-2-yl)benzoate Formula: C18H16NO5- MolecularWeight: 326.32334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(C(=O)CC2=C1)C3=CC=C(C=C3)C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(C(=O)CC2=C1)C3=CC=C(C=C3)C(=O)[O-])OC

InChI

InChI=1S/C18H17NO5/c1-23-15-7-12-9-17(20)19(10-13(12)8-16(15)24-2)14-5-3-11(4-6-14)18(21)22/h3-8H,9-10H2,1-2H3,(H,21,22)/p-1