methyl (2S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoate hydrochloride

Systemtic Name: methyl (2S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoate hydrochloride Openeye Name: methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride CAS Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid methyl ester hydrochloride IUPAC Name: methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride Traditional Name: (2S)-2-amino-3-(3,4-dihydroxyphenyl)propionic acid methyl ester hydrochloride Formula: C10H14ClNO4 MolecularWeight: 247.67546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)[C@H](CC1=CC(=C(C=C1)O)O)N.Cl

InChI

InChI=1S/C10H13NO4.ClH/c1-15-10(14)7(11)4-6-2-3-8(12)9(13)5-6;/h2-3,5,7,12-13H,4,11H2,1H3;1H/t7-;/m0./s1