2-[1-(2-methylpropyl)isoquinolin-5-yl]propanoic acid

Systemtic Name: 2-[1-(2-methylpropyl)isoquinolin-5-yl]propanoic acid Openeye Name: 2-(1-isobutyl-5-isoquinolyl)propanoic acid CAS Name: 2-[1-(2-methylpropyl)-5-isoquinolinyl]propanoic acid IUPAC Name: 2-[1-(2-methylpropyl)isoquinolin-5-yl]propanoic acid Traditional Name: 2-(1-isobutyl-5-isoquinolyl)propionic acid Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC=CC2=C1C=CC=C2C(C)C(=O)O

Isomeric SMILES

CC(C)CC1=NC=CC2=C1C=CC=C2C(C)C(=O)O

InChI

InChI=1S/C16H19NO2/c1-10(2)9-15-14-6-4-5-12(11(3)16(18)19)13(14)7-8-17-15/h4-8,10-11H,9H2,1-3H3,(H,18,19)