4-imidazol-1-yl-3,4-dihydro-2H-1-benzoxepin-5-one

Systemtic Name: 4-imidazol-1-yl-3,4-dihydro-2H-1-benzoxepin-5-one Openeye Name: 4-imidazol-1-yl-3,4-dihydro-2H-1-benzoxepin-5-one CAS Name: 4-(1-imidazolyl)-3,4-dihydro-2H-1-benzoxepin-5-one IUPAC Name: 4-imidazol-1-yl-3,4-dihydro-2H-1-benzoxepin-5-one Traditional Name: 4-imidazol-1-yl-3,4-dihydro-2H-1-benzoxepin-5-one Formula: C13H12N2O2 MolecularWeight: 228.24658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C(=O)C1N3C=CN=C3

Isomeric SMILES

C1COC2=CC=CC=C2C(=O)C1N3C=CN=C3

InChI

InChI=1S/C13H12N2O2/c16-13-10-3-1-2-4-12(10)17-8-5-11(13)15-7-6-14-9-15/h1-4,6-7,9,11H,5,8H2