8-acetamido-4-(3,3-dimethylbutanoylamino)-2,3-bis(oxidanyl)-N-(2-oxidanyl-1,2-diphenyl-ethyl)octanamide

Systemtic Name: 8-acetamido-4-(3,3-dimethylbutanoylamino)-2,3-bis(oxidanyl)-N-(2-oxidanyl-1,2-diphenyl-ethyl)octanamide Openeye Name: 8-acetamido-4-(3,3-dimethylbutanoylamino)-2,3-dihydroxy-N-(2-hydroxy-1,2-diphenyl-ethyl)octanamide CAS Name: 8-acetamido-4-[(3,3-dimethyl-1-oxobutyl)amino]-2,3-dihydroxy-N-(2-hydroxy-1,2-diphenylethyl)octanamide IUPAC Name: 8-acetamido-4-(3,3-dimethylbutanoylamino)-2,3-dihydroxy-N-(2-hydroxy-1,2-diphenylethyl)octanamide Traditional Name: 8-acetamido-4-(3,3-dimethylbutanoylamino)-2,3-dihydroxy-N-(2-hydroxy-1,2-diphenyl-ethyl)caprylamide Formula: C30H43N3O6 MolecularWeight: 541.67892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCCC(C(C(C(=O)NC(C1=CC=CC=C1)C(C2=CC=CC=C2)O)O)O)NC(=O)CC(C)(C)C

Isomeric SMILES

CC(=O)NCCCCC(C(C(C(=O)NC(C1=CC=CC=C1)C(C2=CC=CC=C2)O)O)O)NC(=O)CC(C)(C)C

InChI

InChI=1S/C30H43N3O6/c1-20(34)31-18-12-11-17-23(32-24(35)19-30(2,3)4)27(37)28(38)29(39)33-25(21-13-7-5-8-14-21)26(36)22-15-9-6-10-16-22/h5-10,13-16,23,25-28,36-38H,11-12,17-19H2,1-4H3,(H,31,34)(H,32,35)(H,33,39)