2-chloranyl-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid

Systemtic Name: 2-chloranyl-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid Openeye Name: 2-chloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid CAS Name: 2-chloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid IUPAC Name: 2-chloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid Traditional Name: 2-chloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)enanthic acid Formula: C16H22ClNO2 MolecularWeight: 295.80438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCCCC(C(=O)O)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCCCC(C(=O)O)Cl

InChI

InChI=1S/C16H22ClNO2/c17-15(16(19)20)8-2-1-5-10-18-11-9-13-6-3-4-7-14(13)12-18/h3-4,6-7,15H,1-2,5,8-12H2,(H,19,20)