2-[2-(6,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[2-(6,7-dimethoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-(6,7-dimethoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-(6,7-dimethoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(6,7-dimethoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(2-keto-6,7-dimethoxy-4-methyl-chromen-3-yl)acetyl]amino]propionic acid Formula: C25H24N2O8 MolecularWeight: 480.46666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)OC)OC)CC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O

InChI

InChI=1S/C25H24N2O8/c1-12-15-8-21(33-2)22(34-3)10-20(15)35-25(32)16(12)9-23(29)27-19(24(30)31)6-13-11-26-18-5-4-14(28)7-17(13)18/h4-5,7-8,10-11,19,26,28H,6,9H2,1-3H3,(H,27,29)(H,30,31)