methanesulfonic acid; 2-[3-(1-piperidin-1-ylcyclohexyl)phenoxy]ethanamine

Systemtic Name: methanesulfonic acid; 2-[3-(1-piperidin-1-ylcyclohexyl)phenoxy]ethanamine Openeye Name: methanesulfonic acid; 2-[3-[1-(1-piperidyl)cyclohexyl]phenoxy]ethanamine CAS Name: methanesulfonic acid; 2-[3-[1-(1-piperidinyl)cyclohexyl]phenoxy]ethanamine IUPAC Name: methanesulfonic acid; 2-[3-(1-piperidin-1-ylcyclohexyl)phenoxy]ethanamine Traditional Name: mesylic acid; 2-[3-(1-piperidinocyclohexyl)phenoxy]ethylamine Formula: C20H34N2O4S MolecularWeight: 398.55996

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1CCC(CC1)(C2=CC(=CC=C2)OCCN)N3CCCCC3

Isomeric SMILES

CS(=O)(=O)O.C1CCC(CC1)(C2=CC(=CC=C2)OCCN)N3CCCCC3

InChI

InChI=1S/C19H30N2O.CH4O3S/c20-12-15-22-18-9-7-8-17(16-18)19(10-3-1-4-11-19)21-13-5-2-6-14-21;1-5(2,3)4/h7-9,16H,1-6,10-15,20H2;1H3,(H,2,3,4)