1,6,9-trimethyl-4H-[1]benzoxepino[4,3-d][1,2]oxazol-10-one

Systemtic Name: 1,6,9-trimethyl-4H-[1]benzoxepino[4,3-d][1,2]oxazol-10-one Openeye Name: 1,6,9-trimethyl-4H-[1]benzoxepino[4,3-d]isoxazol-10-one CAS Name: 1,6,9-trimethyl-4H-[1]benzoxepino[4,3-d]isoxazol-10-one IUPAC Name: 1,6,9-trimethyl-4H-[1]benzoxepino[4,3-d][1,2]oxazol-10-one Traditional Name: 1,6,9-trimethyl-4H-[1]benzoxepin[4,3-d]isoxazol-10-one Formula: C14H13NO3 MolecularWeight: 243.25792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)OCC3=C(C2=O)C(=NO3)C

Isomeric SMILES

CC1=C2C(=C(C=C1)C)OCC3=C(C2=O)C(=NO3)C

InChI

InChI=1S/C14H13NO3/c1-7-4-5-8(2)14-11(7)13(16)12-9(3)15-18-10(12)6-17-14/h4-5H,6H2,1-3H3