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

Systemtic Name: 2-azanyl-2-[[3,4-bis(oxidanyl)phenyl]methyl]but-3-enoic acid hydrochloride Openeye Name: 2-amino-2-[(3,4-dihydroxyphenyl)methyl]but-3-enoic acid hydrochloride CAS Name: 2-amino-2-[(3,4-dihydroxyphenyl)methyl]-3-butenoic acid hydrochloride IUPAC Name: 2-amino-2-[(3,4-dihydroxyphenyl)methyl]but-3-enoic acid hydrochloride Traditional Name: 2-amino-2-protocatechuyl-but-3-enoic acid hydrochloride Formula: C11H14ClNO4 MolecularWeight: 259.68616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4.ClH/c1-2-11(12,10(15)16)6-7-3-4-8(13)9(14)5-7;/h2-5,13-14H,1,6,12H2,(H,15,16);1H