2-(2-methoxycarbonyl-1H-isoquinolin-1-yl)ethanoic acid

Systemtic Name: 2-(2-methoxycarbonyl-1H-isoquinolin-1-yl)ethanoic acid Openeye Name: 2-(2-methoxycarbonyl-1H-isoquinolin-1-yl)acetic acid CAS Name: 2-(2-methoxycarbonyl-1H-isoquinolin-1-yl)acetic acid IUPAC Name: 2-(2-methoxycarbonyl-1H-isoquinolin-1-yl)acetic acid Traditional Name: 2-(2-carbomethoxy-1H-isoquinolin-1-yl)acetic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C=CC2=CC=CC=C2C1CC(=O)O

Isomeric SMILES

COC(=O)N1C=CC2=CC=CC=C2C1CC(=O)O

InChI

InChI=1S/C13H13NO4/c1-18-13(17)14-7-6-9-4-2-3-5-10(9)11(14)8-12(15)16/h2-7,11H,8H2,1H3,(H,15,16)