methanesulfonic acid; [2-(3-thiophen-2-ylpropyl)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate

Systemtic Name: methanesulfonic acid; [2-(3-thiophen-2-ylpropyl)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate Openeye Name: methanesulfonic acid; [2-[3-(2-thienyl)propyl]-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [2-(3-thiophen-2-ylpropyl)-3,4-dihydro-1H-isoquinolin-6-yl] ester; methanesulfonic acid IUPAC Name: methanesulfonic acid; [2-(3-thiophen-2-ylpropyl)-3,4-dihydro-1H-isoquinolin-6-yl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [2-[3-(2-thienyl)propyl]-3,4-dihydro-1H-isoquinolin-6-yl] ester; mesylic acid Formula: C20H28N2O5S2 MolecularWeight: 440.57672

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=CC2=C(CN(CC2)CCCC3=CC=CS3)C=C1.CS(=O)(=O)O

Isomeric SMILES

CN(C)C(=O)OC1=CC2=C(CN(CC2)CCCC3=CC=CS3)C=C1.CS(=O)(=O)O

InChI

InChI=1S/C19H24N2O2S.CH4O3S/c1-20(2)19(22)23-17-8-7-16-14-21(11-9-15(16)13-17)10-3-5-18-6-4-12-24-18;1-5(2,3)4/h4,6-8,12-13H,3,5,9-11,14H2,1-2H3;1H3,(H,2,3,4)