2-[[5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid

Systemtic Name: 2-[[5-azanyl-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid Openeye Name: 2-[[5-amino-2-(benzyloxycarbonylamino)-5-oxo-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 2-[[5-amino-1,5-dioxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: 2-[[5-amino-5-oxo-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid Traditional Name: 2-[[5-amino-2-(benzyloxycarbonylamino)-5-keto-pentanoyl]amino]-3-(4-hydroxyphenyl)propionic acid Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCC(=O)N)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCC(=O)N)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C22H25N3O7/c23-19(27)11-10-17(25-22(31)32-13-15-4-2-1-3-5-15)20(28)24-18(21(29)30)12-14-6-8-16(26)9-7-14/h1-9,17-18,26H,10-13H2,(H2,23,27)(H,24,28)(H,25,31)(H,29,30)