2-[(2S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoyl]oxyethyl benzoate

Systemtic Name: 2-[(2S)-2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanoyl]oxyethyl benzoate Openeye Name: 2-[(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoyl]oxyethyl benzoate CAS Name: benzoic acid 2-[(2S)-2-amino-3-(3,4-dihydroxyphenyl)-1-oxopropoxy]ethyl ester IUPAC Name: 2-[(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoyl]oxyethyl benzoate Traditional Name: benzoic acid 2-[(2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoyl]oxyethyl ester Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOC(=O)C(CC2=CC(=C(C=C2)O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOC(=O)[C@H](CC2=CC(=C(C=C2)O)O)N

InChI

InChI=1S/C18H19NO6/c19-14(10-12-6-7-15(20)16(21)11-12)18(23)25-9-8-24-17(22)13-4-2-1-3-5-13/h1-7,11,14,20-21H,8-10,19H2/t14-/m0/s1