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

Systemtic Name: 2,2-bis(chloranyl)-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid Openeye Name: 2,2-dichloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid CAS Name: 2,2-dichloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid IUPAC Name: 2,2-dichloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)heptanoic acid Traditional Name: 2,2-dichloro-7-(3,4-dihydro-1H-isoquinolin-2-yl)enanthic acid Formula: C16H21Cl2NO2 MolecularWeight: 330.24944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21Cl2NO2/c17-16(18,15(20)21)9-4-1-5-10-19-11-8-13-6-2-3-7-14(13)12-19/h2-3,6-7H,1,4-5,8-12H2,(H,20,21)