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

Systemtic Name: [2-oxidanyl-6-(phenethylcarbamoylamino)-3-(phenylcarbonyl)indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [3-benzoyl-2-hydroxy-6-(phenethylcarbamoylamino)indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-benzoyl-2-hydroxy-6-[[oxo-(phenethylamino)methyl]amino]-1-indolyl] ester IUPAC Name: [3-benzoyl-2-hydroxy-6-(phenethylcarbamoylamino)indol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-benzoyl-2-hydroxy-6-(phenethylcarbamoylamino)indol-1-yl] ester Formula: C29H29N3O5 MolecularWeight: 499.55766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)ON1C2=C(C=CC(=C2)NC(=O)NCCC3=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)NCCC3=CC=CC=C3)C(=C1O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H29N3O5/c1-29(2,3)27(35)37-32-23-18-21(31-28(36)30-17-16-19-10-6-4-7-11-19)14-15-22(23)24(26(32)34)25(33)20-12-8-5-9-13-20/h4-15,18,34H,16-17H2,1-3H3,(H2,30,31,36)