3-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propoxy]butanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)OCCCN1CCC2=CC=CC=C2C1

Isomeric SMILES

CC(CC(=O)O)OCCCN1CCC2=CC=CC=C2C1

InChI

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