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

Systemtic Name: ethyl [3-(3-methylbutyl)-5-(oxidanylcarbamoyl)azulen-1-yl] carbonate Openeye Name: ethyl [5-(hydroxycarbamoyl)-3-isopentyl-azulen-1-yl] carbonate CAS Name: carbonic acid ethyl [5-[(hydroxyamino)-oxomethyl]-3-(3-methylbutyl)-1-azulenyl] ester IUPAC Name: ethyl [5-(hydroxycarbamoyl)-3-(3-methylbutyl)azulen-1-yl] carbonate Traditional Name: carbonic acid ethyl [5-(hydroxycarbamoyl)-3-isoamyl-azulen-1-yl] ester Formula: C19H23NO5 MolecularWeight: 345.38962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=C2C=CC=C(C=C2C(=C1)CCC(C)C)C(=O)NO

Isomeric SMILES

CCOC(=O)OC1=C2C=CC=C(C=C2C(=C1)CCC(C)C)C(=O)NO

InChI

InChI=1S/C19H23NO5/c1-4-24-19(22)25-17-11-13(9-8-12(2)3)16-10-14(18(21)20-23)6-5-7-15(16)17/h5-7,10-12,23H,4,8-9H2,1-3H3,(H,20,21)