ethyl [3-hexyl-5-(oxidanylcarbamoyl)azulen-1-yl] carbonate

Systemtic Name: ethyl [3-hexyl-5-(oxidanylcarbamoyl)azulen-1-yl] carbonate Openeye Name: ethyl [3-hexyl-5-(hydroxycarbamoyl)azulen-1-yl] carbonate CAS Name: carbonic acid ethyl [3-hexyl-5-[(hydroxyamino)-oxomethyl]-1-azulenyl] ester IUPAC Name: ethyl [3-hexyl-5-(hydroxycarbamoyl)azulen-1-yl] carbonate Traditional Name: carbonic acid ethyl [3-hexyl-5-(hydroxycarbamoyl)azulen-1-yl] ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C2C1=CC(=CC=C2)C(=O)NO)OC(=O)OCC

Isomeric SMILES

CCCCCCC1=CC(=C2C1=CC(=CC=C2)C(=O)NO)OC(=O)OCC

InChI

InChI=1S/C20H25NO5/c1-3-5-6-7-9-14-13-18(26-20(23)25-4-2)16-11-8-10-15(12-17(14)16)19(22)21-24/h8,10-13,24H,3-7,9H2,1-2H3,(H,21,22)