(3R)-3-[3-[2,4-bis(oxidanyl)phenyl]propylamino]-4-[[(2R)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3R)-3-[3-[2,4-bis(oxidanyl)phenyl]propylamino]-4-[[(2R)-1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3R)-4-[[(1R)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]-3-[3-(2,4-dihydroxyphenyl)propylamino]-4-oxo-butanoic acid CAS Name: (3R)-3-[3-(2,4-dihydroxyphenyl)propylamino]-4-[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: (3R)-3-[3-(2,4-dihydroxyphenyl)propylamino]-4-[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid Traditional Name: (3R)-4-[[(1R)-1-benzyl-2-keto-2-methoxy-ethyl]amino]-3-[3-(2,4-dihydroxyphenyl)propylamino]-4-keto-butyric acid Formula: C23H28N2O7 MolecularWeight: 444.47762

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)O)NCCCC2=C(C=C(C=C2)O)O

Isomeric SMILES

COC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC(=O)O)NCCCC2=C(C=C(C=C2)O)O

InChI

InChI=1S/C23H28N2O7/c1-32-23(31)19(12-15-6-3-2-4-7-15)25-22(30)18(14-21(28)29)24-11-5-8-16-9-10-17(26)13-20(16)27/h2-4,6-7,9-10,13,18-19,24,26-27H,5,8,11-12,14H2,1H3,(H,25,30)(H,28,29)/t18-,19-/m1/s1