methyl 2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-phenylmethoxycarbonyl-amino]propanoate

Systemtic Name: methyl 2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]-phenylmethoxycarbonyl-amino]propanoate Openeye Name: methyl 2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]-benzyloxycarbonyl-amino]propanoate CAS Name: 2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]-phenylmethoxycarbonylamino]propanoic acid methyl ester IUPAC Name: methyl 2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]-phenylmethoxycarbonylamino]propanoate Traditional Name: 2-[carbobenzoxy(tyrosyl)amino]propionic acid methyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N(C(=O)C(CC1=CC=C(C=C1)O)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)OC)N(C(=O)C(CC1=CC=C(C=C1)O)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O6/c1-14(20(26)28-2)23(21(27)29-13-16-6-4-3-5-7-16)19(25)18(22)12-15-8-10-17(24)11-9-15/h3-11,14,18,24H,12-13,22H2,1-2H3