(2R)-2-[2-(4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[2-(4,8-dimethyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[[2-(4,8-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[2-[(4,8-dimethyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate IUPAC Name: (2R)-2-[[2-(4,8-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(2-keto-4,8-dimethyl-chromen-7-yl)oxyacetyl]amino]propionate Formula: C24H21N2O7- MolecularWeight: 449.43274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)N[C@H](CC3=CNC4=C3C=C(C=C4)O)C(=O)[O-]

InChI

InChI=1S/C24H22N2O7/c1-12-7-22(29)33-23-13(2)20(6-4-16(12)23)32-11-21(28)26-19(24(30)31)8-14-10-25-18-5-3-15(27)9-17(14)18/h3-7,9-10,19,25,27H,8,11H2,1-2H3,(H,26,28)(H,30,31)/p-1/t19-/m1/s1