[6-(cyclohexylcarbamoylamino)-3-ethanoyl-2-oxidanyl-indol-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [6-(cyclohexylcarbamoylamino)-3-ethanoyl-2-oxidanyl-indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [3-acetyl-6-(cyclohexylcarbamoylamino)-2-hydroxy-indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-acetyl-6-[[(cyclohexylamino)-oxomethyl]amino]-2-hydroxy-1-indolyl] ester IUPAC Name: [3-acetyl-6-(cyclohexylcarbamoylamino)-2-hydroxyindol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-acetyl-6-(cyclohexylcarbamoylamino)-2-hydroxy-indol-1-yl] ester Formula: C22H29N3O5 MolecularWeight: 415.48276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3CCCCC3)OC(=O)C(C)(C)C)O

Isomeric SMILES

CC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3CCCCC3)OC(=O)C(C)(C)C)O

InChI

InChI=1S/C22H29N3O5/c1-13(26)18-16-11-10-15(24-21(29)23-14-8-6-5-7-9-14)12-17(16)25(19(18)27)30-20(28)22(2,3)4/h10-12,14,27H,5-9H2,1-4H3,(H2,23,24,29)