2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]propanoic acid

Systemtic Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]propanoic acid Openeye Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]propanoic acid CAS Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]propanoic acid IUPAC Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]propanoic acid Traditional Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]propionic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OCCCCN1CCC2=CC=CC=C2C1

Isomeric SMILES

CC(C(=O)O)OCCCCN1CCC2=CC=CC=C2C1

InChI

InChI=1S/C16H23NO3/c1-13(16(18)19)20-11-5-4-9-17-10-8-14-6-2-3-7-15(14)12-17/h2-3,6-7,13H,4-5,8-12H2,1H3,(H,18,19)