5-[(2-azanyl-4,5-dimethyl-phenyl)amino]pentane-1,2,3,4-tetrol chloride

Systemtic Name: 5-[(2-azanyl-4,5-dimethyl-phenyl)amino]pentane-1,2,3,4-tetrol chloride Openeye Name: 5-(2-amino-4,5-dimethyl-anilino)pentane-1,2,3,4-tetrol chloride CAS Name: 5-(2-amino-4,5-dimethylanilino)pentane-1,2,3,4-tetrol chloride IUPAC Name: 5-(2-amino-4,5-dimethylanilino)pentane-1,2,3,4-tetrol chloride Traditional Name: 5-(2-amino-4,5-dimethyl-anilino)pentane-1,2,3,4-tetrol chloride Formula: C13H22ClN2O4- MolecularWeight: 305.77778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NCC(C(C(CO)O)O)O)N.[Cl-]

Isomeric SMILES

CC1=CC(=C(C=C1C)NCC(C(C(CO)O)O)O)N.[Cl-]

InChI

InChI=1S/C13H22N2O4.ClH/c1-7-3-9(14)10(4-8(7)2)15-5-11(17)13(19)12(18)6-16;/h3-4,11-13,15-19H,5-6,14H2,1-2H3;1H/p-1