3-(5-oxidanyl-1H-indol-3-yl)-2-[2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]propanoic acid

Systemtic Name: 3-(5-oxidanyl-1H-indol-3-yl)-2-[2-(3,4,8-trimethyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]propanoic acid Openeye Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[2-(3,4,8-trimethyl-2-oxo-chromen-7-yl)oxypropanoylamino]propanoic acid CAS Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[1-oxo-2-[(3,4,8-trimethyl-2-oxo-1-benzopyran-7-yl)oxy]propyl]amino]propanoic acid IUPAC Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[2-(3,4,8-trimethyl-2-oxochromen-7-yl)oxypropanoylamino]propanoic acid Traditional Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[2-(2-keto-3,4,8-trimethyl-chromen-7-yl)oxypropanoylamino]propionic acid Formula: C26H26N2O7 MolecularWeight: 478.49384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC(C)C(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)C

InChI

InChI=1S/C26H26N2O7/c1-12-13(2)26(33)35-23-14(3)22(8-6-18(12)23)34-15(4)24(30)28-21(25(31)32)9-16-11-27-20-7-5-17(29)10-19(16)20/h5-8,10-11,15,21,27,29H,9H2,1-4H3,(H,28,30)(H,31,32)