2-phenoxyethyl 2-azanyl-4-[3,4-bis(oxidanyl)phenyl]butanoate hydrochloride

Systemtic Name: 2-phenoxyethyl 2-azanyl-4-[3,4-bis(oxidanyl)phenyl]butanoate hydrochloride Openeye Name: 2-phenoxyethyl 2-amino-4-(3,4-dihydroxyphenyl)butanoate hydrochloride CAS Name: 2-amino-4-(3,4-dihydroxyphenyl)butanoic acid 2-phenoxyethyl ester hydrochloride IUPAC Name: 2-phenoxyethyl 2-amino-4-(3,4-dihydroxyphenyl)butanoate hydrochloride Traditional Name: 2-amino-4-(3,4-dihydroxyphenyl)butyric acid 2-phenoxyethyl ester hydrochloride Formula: C18H22ClNO5 MolecularWeight: 367.82398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC(=O)C(CCC2=CC(=C(C=C2)O)O)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)OCCOC(=O)C(CCC2=CC(=C(C=C2)O)O)N.Cl

InChI

InChI=1S/C18H21NO5.ClH/c19-15(8-6-13-7-9-16(20)17(21)12-13)18(22)24-11-10-23-14-4-2-1-3-5-14;/h1-5,7,9,12,15,20-21H,6,8,10-11,19H2;1H