ethyl [3-(2-methylpropyl)-5-(oxidanylcarbamoyl)azulen-1-yl] carbonate

Systemtic Name: ethyl [3-(2-methylpropyl)-5-(oxidanylcarbamoyl)azulen-1-yl] carbonate Openeye Name: ethyl [5-(hydroxycarbamoyl)-3-isobutyl-azulen-1-yl] carbonate CAS Name: carbonic acid ethyl [5-[(hydroxyamino)-oxomethyl]-3-(2-methylpropyl)-1-azulenyl] ester IUPAC Name: ethyl [5-(hydroxycarbamoyl)-3-(2-methylpropyl)azulen-1-yl] carbonate Traditional Name: carbonic acid ethyl [5-(hydroxycarbamoyl)-3-isobutyl-azulen-1-yl] ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO5/c1-4-23-18(21)24-16-10-13(8-11(2)3)15-9-12(17(20)19-22)6-5-7-14(15)16/h5-7,9-11,22H,4,8H2,1-3H3,(H,19,20)