1-(5-butyl-5-oxidanyl-2-oxidanylidene-furan-3-yl)tridecyl N-phenylcarbamate

Systemtic Name: 1-(5-butyl-5-oxidanyl-2-oxidanylidene-furan-3-yl)tridecyl N-phenylcarbamate Openeye Name: 1-(5-butyl-5-hydroxy-2-oxo-3-furyl)tridecyl N-phenylcarbamate CAS Name: N-phenylcarbamic acid 1-(5-butyl-5-hydroxy-2-oxo-3-furanyl)tridecyl ester IUPAC Name: 1-(5-butyl-5-hydroxy-2-oxofuran-3-yl)tridecyl N-phenylcarbamate Traditional Name: N-phenylcarbamic acid 1-(5-butyl-5-hydroxy-2-keto-3-furyl)tridecyl ester Formula: C28H43NO5 MolecularWeight: 473.64472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=CC(OC1=O)(CCCC)O)OC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCC(C1=CC(OC1=O)(CCCC)O)OC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C28H43NO5/c1-3-5-7-8-9-10-11-12-13-17-20-25(33-27(31)29-23-18-15-14-16-19-23)24-22-28(32,21-6-4-2)34-26(24)30/h14-16,18-19,22,25,32H,3-13,17,20-21H2,1-2H3,(H,29,31)