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

Systemtic Name: 2-methyl-2-[(10-methylsulfonylanthracen-9-yl)methylamino]propane-1,3-diol hydrochloride Openeye Name: 2-methyl-2-[(10-methylsulfonyl-9-anthryl)methylamino]propane-1,3-diol hydrochloride CAS Name: 2-methyl-2-[(10-methylsulfonyl-9-anthracenyl)methylamino]propane-1,3-diol hydrochloride IUPAC Name: 2-methyl-2-[(10-methylsulfonylanthracen-9-yl)methylamino]propane-1,3-diol hydrochloride Traditional Name: 2-[(10-mesyl-9-anthryl)methylamino]-2-methyl-propane-1,3-diol hydrochloride Formula: C20H24ClNO4S MolecularWeight: 409.92686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO4S.ClH/c1-20(12-22,13-23)21-11-18-14-7-3-5-9-16(14)19(26(2,24)25)17-10-6-4-8-15(17)18;/h3-10,21-23H,11-13H2,1-2H3;1H