3-(1H-indol-3-yl)-2-[3-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[3-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)propanoylamino]propanoic acid Openeye Name: 2-[3-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[3-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[3-(7-hydroxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[3-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)propanoylamino]-3-(1H-indol-3-yl)propionic acid Formula: C24H22N2O6 MolecularWeight: 434.44128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C24H22N2O6/c1-13-16-7-6-15(27)11-21(16)32-24(31)17(13)8-9-22(28)26-20(23(29)30)10-14-12-25-19-5-3-2-4-18(14)19/h2-7,11-12,20,25,27H,8-10H2,1H3,(H,26,28)(H,29,30)