N-[[1-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]piperidin-4-yl]methyl]-3-ethoxy-pyridin-2-amine; methanesulfonate

Systemtic Name: N-[[1-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]piperidin-4-yl]methyl]-3-ethoxy-pyridin-2-amine; methanesulfonate Openeye Name: 3-ethoxy-N-[[1-(2-isochroman-1-ylethyl)-4-piperidyl]methyl]pyridin-2-amine; methanesulfonate CAS Name: N-[[1-[2-(3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-4-piperidinyl]methyl]-3-ethoxy-2-pyridinamine; methanesulfonate IUPAC Name: N-[[1-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]piperidin-4-yl]methyl]-3-ethoxypyridin-2-amine; methanesulfonate Traditional Name: (3-ethoxy-2-pyridyl)-[[1-(2-isochroman-1-ylethyl)-4-piperidyl]methyl]amine mesylate Formula: C25H36N3O5S- MolecularWeight: 490.63544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=CC=C1)NCC2CCN(CC2)CCC3C4=CC=CC=C4CCO3.CS(=O)(=O)[O-]

Isomeric SMILES

CCOC1=C(N=CC=C1)NCC2CCN(CC2)CCC3C4=CC=CC=C4CCO3.CS(=O)(=O)[O-]

InChI

InChI=1S/C24H33N3O2.CH4O3S/c1-2-28-23-8-5-13-25-24(23)26-18-19-9-14-27(15-10-19)16-11-22-21-7-4-3-6-20(21)12-17-29-22;1-5(2,3)4/h3-8,13,19,22H,2,9-12,14-18H2,1H3,(H,25,26);1H3,(H,2,3,4)/p-1