2-isoquinolin-2-ium-2-ylethanoic acid

Systemtic Name: 2-isoquinolin-2-ium-2-ylethanoic acid Openeye Name: 2-isoquinolin-2-ium-2-ylacetic acid CAS Name: 2-(2-isoquinolin-2-iumyl)acetic acid IUPAC Name: 2-isoquinolin-2-ium-2-ylacetic acid Traditional Name: 2-isoquinolin-2-ium-2-ylacetic acid Formula: C11H10NO2+ MolecularWeight: 188.2026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)O

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)O

InChI

InChI=1S/C11H9NO2/c13-11(14)8-12-6-5-9-3-1-2-4-10(9)7-12/h1-7H,8H2/p+1