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

Systemtic Name: 2-[(2-tert-butyl-10-chloranyl-anthracen-9-yl)methylamino]-2-methyl-propane-1,3-diol hydrochloride Openeye Name: 2-[(2-tert-butyl-10-chloro-9-anthryl)methylamino]-2-methyl-propane-1,3-diol hydrochloride CAS Name: 2-[(2-tert-butyl-10-chloro-9-anthracenyl)methylamino]-2-methylpropane-1,3-diol hydrochloride IUPAC Name: 2-[(2-tert-butyl-10-chloroanthracen-9-yl)methylamino]-2-methylpropane-1,3-diol hydrochloride Traditional Name: 2-[(2-tert-butyl-10-chloro-9-anthryl)methylamino]-2-methyl-propane-1,3-diol hydrochloride Formula: C23H29Cl2NO2 MolecularWeight: 422.38786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C3=CC=CC=C3C(=C2C=C1)Cl)CNC(C)(CO)CO.Cl

Isomeric SMILES

CC(C)(C)C1=CC2=C(C3=CC=CC=C3C(=C2C=C1)Cl)CNC(C)(CO)CO.Cl

InChI

InChI=1S/C23H28ClNO2.ClH/c1-22(2,3)15-9-10-18-19(11-15)20(12-25-23(4,13-26)14-27)16-7-5-6-8-17(16)21(18)24;/h5-11,25-27H,12-14H2,1-4H3;1H