[6-[(4-chlorophenyl)carbamoylamino]-3-ethanoyl-2-oxidanyl-indol-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [6-[(4-chlorophenyl)carbamoylamino]-3-ethanoyl-2-oxidanyl-indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [3-acetyl-6-[(4-chlorophenyl)carbamoylamino]-2-hydroxy-indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-acetyl-6-[[(4-chloroanilino)-oxomethyl]amino]-2-hydroxy-1-indolyl] ester IUPAC Name: [3-acetyl-6-[(4-chlorophenyl)carbamoylamino]-2-hydroxyindol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-acetyl-6-[(4-chlorophenyl)carbamoylamino]-2-hydroxy-indol-1-yl] ester Formula: C22H22ClN3O5 MolecularWeight: 443.88018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)Cl)OC(=O)C(C)(C)C)O

Isomeric SMILES

CC(=O)C1=C(N(C2=C1C=CC(=C2)NC(=O)NC3=CC=C(C=C3)Cl)OC(=O)C(C)(C)C)O

InChI

InChI=1S/C22H22ClN3O5/c1-12(27)18-16-10-9-15(25-21(30)24-14-7-5-13(23)6-8-14)11-17(16)26(19(18)28)31-20(29)22(2,3)4/h5-11,28H,1-4H3,(H2,24,25,30)