[1-[1-(2-chlorophenyl)cyclopropyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] dodecanoate

Systemtic Name: [1-[1-(2-chlorophenyl)cyclopropyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] dodecanoate Openeye Name: [1-[1-(2-chlorophenyl)cyclopropyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] dodecanoate CAS Name: dodecanoic acid [1-[1-(2-chlorophenyl)cyclopropyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] ester IUPAC Name: [1-[1-(2-chlorophenyl)cyclopropyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] dodecanoate Traditional Name: lauric acid [1-[1-(2-chlorophenyl)cyclopropyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] ester Formula: C32H44ClNO3 MolecularWeight: 526.14966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1=C(C=C2CCN(C(C2=C1)C3(CC3)C4=CC=CC=C4Cl)C)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1=C(C=C2CCN(C(C2=C1)C3(CC3)C4=CC=CC=C4Cl)C)OC

InChI

InChI=1S/C32H44ClNO3/c1-4-5-6-7-8-9-10-11-12-17-30(35)37-29-23-25-24(22-28(29)36-3)18-21-34(2)31(25)32(19-20-32)26-15-13-14-16-27(26)33/h13-16,22-23,31H,4-12,17-21H2,1-3H3