3-(3-methoxyphenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylate

Systemtic Name: 3-(3-methoxyphenyl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylate Openeye Name: 3-(3-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylate CAS Name: 3-(3-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylate IUPAC Name: 3-(3-methoxyphenyl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxylate Traditional Name: 1-keto-3-(3-methoxyphenyl)-2-methyl-3,4-dihydroisoquinoline-4-carboxylate Formula: C18H16NO4- MolecularWeight: 310.32394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)[O-])C3=CC(=CC=C3)OC

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)[O-])C3=CC(=CC=C3)OC

InChI

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