3-(4-hydroxyphenyl)-2-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoylamino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[2-[2-(phenylmethoxycarbonylamino)ethanoylamino]ethanoylamino]propanoic acid Openeye Name: 2-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetyl]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[1-oxo-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]ethyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]propanoic acid Traditional Name: 2-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]acetyl]amino]-3-(4-hydroxyphenyl)propionic acid Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC(=O)NCC(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C21H23N3O7/c25-16-8-6-14(7-9-16)10-17(20(28)29)24-19(27)12-22-18(26)11-23-21(30)31-13-15-4-2-1-3-5-15/h1-9,17,25H,10-13H2,(H,22,26)(H,23,30)(H,24,27)(H,28,29)