(2E,3E)-3-(2-bromanyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile

Systemtic Name: (2E,3E)-3-(2-bromanyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile Openeye Name: (2E,3E)-3-(2-bromo-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile CAS Name: (2E,3E)-3-(2-bromo-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile IUPAC Name: (2E,3E)-3-(2-bromo-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile Traditional Name: (2E,3E)-3-(2-bromo-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-(5-methyl-1,3-dihydrobenzimidazol-2-ylidene)propionitrile Formula: C19H16BrN3O2 MolecularWeight: 398.25324

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C2NC3=C(N2)C=C(C=C3)C)C#N)C(=CC1=O)Br

Isomeric SMILES

CCOC1=C/C(=C\C(=C/2\NC3=C(N2)C=C(C=C3)C)\C#N)/C(=CC1=O)Br

InChI

InChI=1S/C19H16BrN3O2/c1-3-25-18-8-12(14(20)9-17(18)24)7-13(10-21)19-22-15-5-4-11(2)6-16(15)23-19/h4-9,22-23H,3H2,1-2H3/b12-7+,19-13+