[2-oxidanyl-3-(phenylcarbonyl)-6-[(phenylmethyl)carbamoylamino]indol-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [2-oxidanyl-3-(phenylcarbonyl)-6-[(phenylmethyl)carbamoylamino]indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [3-benzoyl-6-(benzylcarbamoylamino)-2-hydroxy-indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-benzoyl-2-hydroxy-6-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-indolyl] ester IUPAC Name: [3-benzoyl-6-(benzylcarbamoylamino)-2-hydroxyindol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-benzoyl-6-(benzylcarbamoylamino)-2-hydroxy-indol-1-yl] ester Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NC(=O)NCC3=CC=CC=C3)C(=C1O)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NC(=O)NCC3=CC=CC=C3)C(=C1O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O5/c1-28(2,3)26(34)36-31-22-16-20(30-27(35)29-17-18-10-6-4-7-11-18)14-15-21(22)23(25(31)33)24(32)19-12-8-5-9-13-19/h4-16,33H,17H2,1-3H3,(H2,29,30,35)