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

Systemtic Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)benzoate Openeye Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)benzoate CAS Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)benzoate IUPAC Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)benzoate Traditional Name: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)benzoate Formula: C18H16NO4- MolecularWeight: 310.32394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2C3=CC=CC=C3C(=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2C3=CC=CC=C3C(=O)[O-])OC

InChI

InChI=1S/C18H17NO4/c1-22-15-9-11-7-8-19-17(14(11)10-16(15)23-2)12-5-3-4-6-13(12)18(20)21/h3-6,9-10H,7-8H2,1-2H3,(H,20,21)/p-1