[7-[(1-methylpiperidin-4-yl)methyl-propyl-amino]-5,6,7,8-tetrahydronaphthalen-2-yl] methanesulfonate

Systemtic Name: [7-[(1-methylpiperidin-4-yl)methyl-propyl-amino]-5,6,7,8-tetrahydronaphthalen-2-yl] methanesulfonate Openeye Name: [3-[(1-methyl-4-piperidyl)methyl-propyl-amino]tetralin-6-yl] methanesulfonate CAS Name: methanesulfonic acid [7-[(1-methyl-4-piperidinyl)methyl-propylamino]-5,6,7,8-tetrahydronaphthalen-2-yl] ester IUPAC Name: [7-[(1-methylpiperidin-4-yl)methyl-propylamino]-5,6,7,8-tetrahydronaphthalen-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-[(1-methyl-4-piperidyl)methyl-propyl-amino]tetralin-6-yl] ester Formula: C21H34N2O3S MolecularWeight: 394.57126

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CCN(CC1)C)C2CCC3=C(C2)C=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

CCCN(CC1CCN(CC1)C)C2CCC3=C(C2)C=C(C=C3)OS(=O)(=O)C

InChI

InChI=1S/C21H34N2O3S/c1-4-11-23(16-17-9-12-22(2)13-10-17)20-7-5-18-6-8-21(15-19(18)14-20)26-27(3,24)25/h6,8,15,17,20H,4-5,7,9-14,16H2,1-3H3