2-[3-(3-chlorophenyl)propyl]-6-methoxy-3,4-dihydro-1H-isoquinoline; methanesulfonic acid

Systemtic Name: 2-[3-(3-chlorophenyl)propyl]-6-methoxy-3,4-dihydro-1H-isoquinoline; methanesulfonic acid Openeye Name: 2-[3-(3-chlorophenyl)propyl]-6-methoxy-3,4-dihydro-1H-isoquinoline; methanesulfonic acid CAS Name: 2-[3-(3-chlorophenyl)propyl]-6-methoxy-3,4-dihydro-1H-isoquinoline; methanesulfonic acid IUPAC Name: 2-[3-(3-chlorophenyl)propyl]-6-methoxy-3,4-dihydro-1H-isoquinoline; methanesulfonic acid Traditional Name: 2-[3-(3-chlorophenyl)propyl]-6-methoxy-3,4-dihydro-1H-isoquinoline; mesylic acid Formula: C20H26ClNO4S MolecularWeight: 411.94274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(CC2)CCCC3=CC(=CC=C3)Cl)C=C1.CS(=O)(=O)O

Isomeric SMILES

COC1=CC2=C(CN(CC2)CCCC3=CC(=CC=C3)Cl)C=C1.CS(=O)(=O)O

InChI

InChI=1S/C19H22ClNO.CH4O3S/c1-22-19-8-7-17-14-21(11-9-16(17)13-19)10-3-5-15-4-2-6-18(20)12-15;1-5(2,3)4/h2,4,6-8,12-13H,3,5,9-11,14H2,1H3;1H3,(H,2,3,4)