ethyl [3-hexyl-2-methyl-6-(oxidanylcarbamoyl)azulen-1-yl] carbonate

Systemtic Name: ethyl [3-hexyl-2-methyl-6-(oxidanylcarbamoyl)azulen-1-yl] carbonate Openeye Name: ethyl [3-hexyl-6-(hydroxycarbamoyl)-2-methyl-azulen-1-yl] carbonate CAS Name: carbonic acid ethyl [3-hexyl-6-[(hydroxyamino)-oxomethyl]-2-methyl-1-azulenyl] ester IUPAC Name: ethyl [3-hexyl-6-(hydroxycarbamoyl)-2-methylazulen-1-yl] carbonate Traditional Name: carbonic acid ethyl [3-hexyl-6-(hydroxycarbamoyl)-2-methyl-azulen-1-yl] ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C=CC(=CC=C2C(=C1C)OC(=O)OCC)C(=O)NO

Isomeric SMILES

CCCCCCC1=C2C=CC(=CC=C2C(=C1C)OC(=O)OCC)C(=O)NO

InChI

InChI=1S/C21H27NO5/c1-4-6-7-8-9-16-14(3)19(27-21(24)26-5-2)18-13-11-15(20(23)22-25)10-12-17(16)18/h10-13,25H,4-9H2,1-3H3,(H,22,23)