8-(7-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)octanoic acid

Systemtic Name: 8-(7-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)octanoic acid Openeye Name: 8-(7-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)octanoic acid CAS Name: 8-(7-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)octanoic acid IUPAC Name: 8-(7-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)octanoic acid Traditional Name: 8-(7-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)caprylic acid Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)C3=CC=CC=C3)CCCCCCCC(=O)O

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)C3=CC=CC=C3)CCCCCCCC(=O)O

InChI

InChI=1S/C23H29NO2/c25-23(26)11-7-2-1-3-8-15-24-16-14-20-12-13-21(17-22(20)18-24)19-9-5-4-6-10-19/h4-6,9-10,12-13,17H,1-3,7-8,11,14-16,18H2,(H,25,26)