2-methyl-2-[[10-(3-oxidanylpropoxy)anthracen-9-yl]methylamino]propane-1,3-diol hydrochloride

Systemtic Name: 2-methyl-2-[[10-(3-oxidanylpropoxy)anthracen-9-yl]methylamino]propane-1,3-diol hydrochloride Openeye Name: 2-[[10-(3-hydroxypropoxy)-9-anthryl]methylamino]-2-methyl-propane-1,3-diol hydrochloride CAS Name: 2-[[10-(3-hydroxypropoxy)-9-anthracenyl]methylamino]-2-methylpropane-1,3-diol hydrochloride IUPAC Name: 2-[[10-(3-hydroxypropoxy)anthracen-9-yl]methylamino]-2-methylpropane-1,3-diol hydrochloride Traditional Name: 2-[[10-(3-hydroxypropoxy)-9-anthryl]methylamino]-2-methyl-propane-1,3-diol hydrochloride Formula: C22H28ClNO4 MolecularWeight: 405.91502

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=C2C=CC=CC2=C(C3=CC=CC=C31)OCCCO.Cl

Isomeric SMILES

CC(CO)(CO)NCC1=C2C=CC=CC2=C(C3=CC=CC=C31)OCCCO.Cl

InChI

InChI=1S/C22H27NO4.ClH/c1-22(14-25,15-26)23-13-20-16-7-2-4-9-18(16)21(27-12-6-11-24)19-10-5-3-8-17(19)20;/h2-5,7-10,23-26H,6,11-15H2,1H3;1H