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

Systemtic Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]ethanoic acid Openeye Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]acetic acid CAS Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]acetic acid IUPAC Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]acetic acid Traditional Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butoxy]acetic acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCCOCC(=O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCCOCC(=O)O

InChI

InChI=1S/C15H21NO3/c17-15(18)12-19-10-4-3-8-16-9-7-13-5-1-2-6-14(13)11-16/h1-2,5-6H,3-4,7-12H2,(H,17,18)