(2R)-2-[2-[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[2-[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoylamino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[2-(3-benzyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[2-[[4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[2-(3-benzyl-2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]-3-phenyl-propionic acid Formula: C28H25NO6 MolecularWeight: 471.5012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=CC=C3)C(=O)O)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)N[C@H](CC3=CC=CC=C3)C(=O)O)CC4=CC=CC=C4

InChI

InChI=1S/C28H25NO6/c1-18-22-13-12-21(16-25(22)35-28(33)23(18)14-19-8-4-2-5-9-19)34-17-26(30)29-24(27(31)32)15-20-10-6-3-7-11-20/h2-13,16,24H,14-15,17H2,1H3,(H,29,30)(H,31,32)/t24-/m1/s1