2-(anthracen-2-ylmethylamino)-2-methyl-propane-1,3-diol hydrate dihydrochloride

Systemtic Name: 2-(anthracen-2-ylmethylamino)-2-methyl-propane-1,3-diol hydrate dihydrochloride Openeye Name: 2-(2-anthrylmethylamino)-2-methyl-propane-1,3-diol hydrate dihydrochloride CAS Name: 2-(2-anthracenylmethylamino)-2-methylpropane-1,3-diol hydrate dihydrochloride IUPAC Name: 2-(anthracen-2-ylmethylamino)-2-methylpropane-1,3-diol hydrate dihydrochloride Traditional Name: 2-(2-anthrylmethylamino)-2-methyl-propane-1,3-diol hydrate dihydrochloride Formula: C38H46Cl2N2O5 MolecularWeight: 681.68824

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NCC1=CC2=CC3=CC=CC=C3C=C2C=C1.CC(CO)(CO)NCC1=CC2=CC3=CC=CC=C3C=C2C=C1.O.Cl.Cl

Isomeric SMILES

CC(CO)(CO)NCC1=CC2=CC3=CC=CC=C3C=C2C=C1.CC(CO)(CO)NCC1=CC2=CC3=CC=CC=C3C=C2C=C1.O.Cl.Cl

InChI

InChI=1S/2C19H21NO2.2ClH.H2O/c2*1-19(12-21,13-22)20-11-14-6-7-17-9-15-4-2-3-5-16(15)10-18(17)8-14;;;/h2*2-10,20-22H,11-13H2,1H3;2*1H;1H2