4-[[1-(2,2-dimethylpropanoyloxy)-2-oxidanyl-3-(phenylcarbonyl)indol-6-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[1-(2,2-dimethylpropanoyloxy)-2-oxidanyl-3-(phenylcarbonyl)indol-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-benzoyl-1-(2,2-dimethylpropanoyloxy)-2-hydroxy-indol-6-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[3-benzoyl-1-(2,2-dimethyl-1-oxopropoxy)-2-hydroxy-6-indolyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[3-benzoyl-1-(2,2-dimethylpropanoyloxy)-2-hydroxyindol-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[(3-benzoyl-2-hydroxy-1-pivaloyloxy-indol-6-yl)amino]-4-keto-butyric acid Formula: C24H24N2O7 MolecularWeight: 452.45656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NC(=O)CCC(=O)O)C(=C1O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NC(=O)CCC(=O)O)C(=C1O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H24N2O7/c1-24(2,3)23(32)33-26-17-13-15(25-18(27)11-12-19(28)29)9-10-16(17)20(22(26)31)21(30)14-7-5-4-6-8-14/h4-10,13,31H,11-12H2,1-3H3,(H,25,27)(H,28,29)