1-[(2-oxidanylnaphthalen-1-yl)methyl-(2-oxidanylpropyl)amino]propan-2-yl methanesulfonate

Systemtic Name: 1-[(2-oxidanylnaphthalen-1-yl)methyl-(2-oxidanylpropyl)amino]propan-2-yl methanesulfonate Openeye Name: [2-[(2-hydroxy-1-naphthyl)methyl-(2-hydroxypropyl)amino]-1-methyl-ethyl] methanesulfonate CAS Name: methanesulfonic acid 1-[(2-hydroxy-1-naphthalenyl)methyl-(2-hydroxypropyl)amino]propan-2-yl ester IUPAC Name: 1-[(2-hydroxynaphthalen-1-yl)methyl-(2-hydroxypropyl)amino]propan-2-yl methanesulfonate Traditional Name: methanesulfonic acid [2-[(2-hydroxy-1-naphthyl)methyl-(2-hydroxypropyl)amino]-1-methyl-ethyl] ester Formula: C18H25NO5S MolecularWeight: 367.4598

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC1=C(C=CC2=CC=CC=C21)O)CC(C)OS(=O)(=O)C)O

Isomeric SMILES

CC(CN(CC1=C(C=CC2=CC=CC=C21)O)CC(C)OS(=O)(=O)C)O

InChI

InChI=1S/C18H25NO5S/c1-13(20)10-19(11-14(2)24-25(3,22)23)12-17-16-7-5-4-6-15(16)8-9-18(17)21/h4-9,13-14,20-21H,10-12H2,1-3H3