5-[7-oxidanylidene-12-(3-oxidanylidene-1,2-oxazol-5-yl)-2,12-diphenyl-tridecan-2-yl]-1,2-oxazol-3-one

Systemtic Name: 5-[7-oxidanylidene-12-(3-oxidanylidene-1,2-oxazol-5-yl)-2,12-diphenyl-tridecan-2-yl]-1,2-oxazol-3-one Openeye Name: 5-[1-methyl-6-oxo-11-(3-oxoisoxazol-5-yl)-1,11-diphenyl-dodecyl]isoxazol-3-one CAS Name: 5-[7-oxo-12-(3-oxo-5-isoxazolyl)-2,12-diphenyltridecan-2-yl]-3-isoxazolone IUPAC Name: 5-[7-oxo-12-(3-oxo-1,2-oxazol-5-yl)-2,12-diphenyltridecan-2-yl]-1,2-oxazol-3-one Traditional Name: 5-[6-keto-11-(3-keto-4-isoxazolin-5-yl)-1-methyl-1,11-diphenyl-dodecyl]-4-isoxazolin-3-one Formula: C31H36N2O5 MolecularWeight: 516.62794

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(=O)CCCCC(C)(C1=CC=CC=C1)C2=CC(=O)NO2)(C3=CC=CC=C3)C4=CC(=O)NO4

Isomeric SMILES

CC(CCCCC(=O)CCCCC(C)(C1=CC=CC=C1)C2=CC(=O)NO2)(C3=CC=CC=C3)C4=CC(=O)NO4

InChI

InChI=1S/C31H36N2O5/c1-30(23-13-5-3-6-14-23,26-21-28(35)32-37-26)19-11-9-17-25(34)18-10-12-20-31(2,24-15-7-4-8-16-24)27-22-29(36)33-38-27/h3-8,13-16,21-22H,9-12,17-20H2,1-2H3,(H,32,35)(H,33,36)