2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-2-methyl-propanoic acid dihydrate hydrochloride

Systemtic Name: 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]-2-methyl-propanoic acid dihydrate hydrochloride Openeye Name: 2-amino-3-(3,4-dihydroxyphenyl)-2-methyl-propanoic acid dihydrate hydrochloride CAS Name: 2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid dihydrate hydrochloride IUPAC Name: 2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoic acid dihydrate hydrochloride Traditional Name: 2-amino-3-(3,4-dihydroxyphenyl)-2-methyl-propionic acid dihydrate hydrochloride Formula: C10H18ClNO6 MolecularWeight: 283.70602

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N.O.O.Cl

Isomeric SMILES

CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N.O.O.Cl

InChI

InChI=1S/C10H13NO4.ClH.2H2O/c1-10(11,9(14)15)5-6-2-3-7(12)8(13)4-6;;;/h2-4,12-13H,5,11H2,1H3,(H,14,15);1H;2*1H2