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

Systemtic Name: [6-(cyclohexylcarbamoylamino)-2-oxidanyl-3-propanoyl-indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [6-(cyclohexylcarbamoylamino)-2-hydroxy-3-propanoyl-indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [6-[[(cyclohexylamino)-oxomethyl]amino]-2-hydroxy-3-(1-oxopropyl)-1-indolyl] ester IUPAC Name: [6-(cyclohexylcarbamoylamino)-2-hydroxy-3-propanoylindol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [6-(cyclohexylcarbamoylamino)-2-hydroxy-3-propionyl-indol-1-yl] ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5/c1-5-18(27)19-16-12-11-15(25-22(30)24-14-9-7-6-8-10-14)13-17(16)26(20(19)28)31-21(29)23(2,3)4/h11-14,28H,5-10H2,1-4H3,(H2,24,25,30)