(2S)-2-[[(2S)-1-[[(1S)-1,3-bis(oxidanyl)-3-oxidanylidene-propyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-(4-hydroxyphenyl)butanoic acid

Systemtic Name: (2S)-2-[[(2S)-1-[[(1S)-1,3-bis(oxidanyl)-3-oxidanylidene-propyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-(4-hydroxyphenyl)butanoic acid Openeye Name: (2S)-2-[[(1S)-1-benzyl-2-[[(1S)-1,3-dihydroxy-3-oxo-propyl]amino]-2-oxo-ethyl]amino]-4-(4-hydroxyphenyl)butanoic acid CAS Name: (2S)-2-[[(2S)-1-[[(1S)-1,3-dihydroxy-3-oxopropyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-4-(4-hydroxyphenyl)butanoic acid IUPAC Name: (2S)-2-[[(2S)-1-[[(1S)-1,3-dihydroxy-3-oxopropyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-4-(4-hydroxyphenyl)butanoic acid Traditional Name: (2S)-2-[[(1S)-1-benzyl-2-[[(1S)-1,3-dihydroxy-3-keto-propyl]amino]-2-keto-ethyl]amino]-4-(4-hydroxyphenyl)butyric acid Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC(=O)O)O)NC(CCC2=CC=C(C=C2)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@H](CC(=O)O)O)N[C@@H](CCC2=CC=C(C=C2)O)C(=O)O

InChI

InChI=1S/C22H26N2O7/c25-16-9-6-14(7-10-16)8-11-17(22(30)31)23-18(12-15-4-2-1-3-5-15)21(29)24-19(26)13-20(27)28/h1-7,9-10,17-19,23,25-26H,8,11-13H2,(H,24,29)(H,27,28)(H,30,31)/t17-,18-,19-/m0/s1