(4Z)-4-(5-methoxy-1,2-dihydrobenzotriazol-4-ylidene)-5-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: (4Z)-4-(5-methoxy-1,2-dihydrobenzotriazol-4-ylidene)-5-oxidanyl-cyclohex-2-en-1-one Openeye Name: (4Z)-5-hydroxy-4-(5-methoxy-1,2-dihydrobenzotriazol-4-ylidene)cyclohex-2-en-1-one CAS Name: (4Z)-5-hydroxy-4-(5-methoxy-1,2-dihydrobenzotriazol-4-ylidene)-1-cyclohex-2-enone IUPAC Name: (4Z)-5-hydroxy-4-(5-methoxy-1,2-dihydrobenzotriazol-4-ylidene)cyclohex-2-en-1-one Traditional Name: (4Z)-5-hydroxy-4-(5-methoxy-1,2-dihydrobenzotriazol-4-ylidene)cyclohex-2-en-1-one Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C2C(=NNN2)C1=C3C=CC(=O)CC3O

Isomeric SMILES

COC\1=CC=C2C(=NNN2)/C1=C/3\C=CC(=O)CC3O

InChI

InChI=1S/C13H13N3O3/c1-19-11-5-4-9-13(15-16-14-9)12(11)8-3-2-7(17)6-10(8)18/h2-5,10,14,16,18H,6H2,1H3/b12-8+