3-[1-(2-ethylbutanoyloxy)-5-methoxy-2-(3-methylphenyl)carbonyl-indol-3-yl]oxy-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[1-(2-ethylbutanoyloxy)-5-methoxy-2-(3-methylphenyl)carbonyl-indol-3-yl]oxy-3-oxidanylidene-propanoic acid Openeye Name: 3-[1-(2-ethylbutanoyloxy)-5-methoxy-2-(3-methylbenzoyl)indol-3-yl]oxy-3-oxo-propanoic acid CAS Name: 3-[[1-(2-ethyl-1-oxobutoxy)-5-methoxy-2-[(3-methylphenyl)-oxomethyl]-3-indolyl]oxy]-3-oxopropanoic acid IUPAC Name: 3-[1-(2-ethylbutanoyloxy)-5-methoxy-2-(3-methylbenzoyl)indol-3-yl]oxy-3-oxopropanoic acid Traditional Name: 3-[1-(2-ethylbutanoyloxy)-5-methoxy-2-m-toluoyl-indol-3-yl]oxy-3-keto-propionic acid Formula: C26H27NO8 MolecularWeight: 481.49448

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)ON1C2=C(C=C(C=C2)OC)C(=C1C(=O)C3=CC(=CC=C3)C)OC(=O)CC(=O)O

Isomeric SMILES

CCC(CC)C(=O)ON1C2=C(C=C(C=C2)OC)C(=C1C(=O)C3=CC(=CC=C3)C)OC(=O)CC(=O)O

InChI

InChI=1S/C26H27NO8/c1-5-16(6-2)26(32)35-27-20-11-10-18(33-4)13-19(20)25(34-22(30)14-21(28)29)23(27)24(31)17-9-7-8-15(3)12-17/h7-13,16H,5-6,14H2,1-4H3,(H,28,29)