2-[1-(4-dimethylaminophenyl)isoquinolin-5-yl]ethanoic acid

Systemtic Name: 2-[1-(4-dimethylaminophenyl)isoquinolin-5-yl]ethanoic acid Openeye Name: 2-[1-(4-dimethylaminophenyl)-5-isoquinolyl]acetic acid CAS Name: 2-[1-(4-dimethylaminophenyl)-5-isoquinolinyl]acetic acid IUPAC Name: 2-[1-(4-dimethylaminophenyl)isoquinolin-5-yl]acetic acid Traditional Name: 2-[1-(4-dimethylaminophenyl)-5-isoquinolyl]acetic acid Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC=CC3=C2C=CC=C3CC(=O)O

InChI

InChI=1S/C19H18N2O2/c1-21(2)15-8-6-13(7-9-15)19-17-5-3-4-14(12-18(22)23)16(17)10-11-20-19/h3-11H,12H2,1-2H3,(H,22,23)