4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-2H-1,2-oxazol-5-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-2H-1,2-oxazol-5-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-2H-isoxazol-5-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-2H-isoxazol-5-ylidene]-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-2H-1,2-oxazol-5-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-methyl-3-isoxazolin-5-ylidene]-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C19H17NO5 MolecularWeight: 339.34198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=O)C=C2O)ON1)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=C(C(=C2C=CC(=O)C=C2O)ON1)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C19H17NO5/c1-11-18(12-3-6-16-17(9-12)24-8-2-7-23-16)19(25-20-11)14-5-4-13(21)10-15(14)22/h3-6,9-10,20,22H,2,7-8H2,1H3