actinium; methyl 3-ethanoyl-1,4-dihydroisoquinolin-2-ide-3-carboxylate

Systemtic Name: actinium; methyl 3-ethanoyl-1,4-dihydroisoquinolin-2-ide-3-carboxylate Openeye Name: actinium; methyl 3-acetyl-1,4-dihydroisoquinolin-2-ide-3-carboxylate CAS Name: 3-acetyl-1,4-dihydroisoquinolin-2-ide-3-carboxylic acid methyl ester; actinium IUPAC Name: actinium; methyl 3-acetyl-1,4-dihydroisoquinolin-2-ide-3-carboxylate Traditional Name: 3-acetyl-1,4-dihydroisoquinolin-2-ide-3-carboxylic acid methyl ester; actinium Formula: C13H14AcNO3- MolecularWeight: 459.282907

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CC2=CC=CC=C2C[N-]1)C(=O)OC.[Ac]

Isomeric SMILES

CC(=O)C1(CC2=CC=CC=C2C[N-]1)C(=O)OC.[Ac]

InChI

InChI=1S/C13H14NO3.Ac/c1-9(15)13(12(16)17-2)7-10-5-3-4-6-11(10)8-14-13;/h3-6H,7-8H2,1-2H3;/q-1;