2-(5-methoxy-1,3-dihydrobenzimidazol-2-ylidene)-3-(3-methoxy-4-oxidanylidene-5-prop-2-enyl-cyclohexa-2,5-dien-1-ylidene)propanenitrile

Systemtic Name: 2-(5-methoxy-1,3-dihydrobenzimidazol-2-ylidene)-3-(3-methoxy-4-oxidanylidene-5-prop-2-enyl-cyclohexa-2,5-dien-1-ylidene)propanenitrile Openeye Name: 3-(3-allyl-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-(5-methoxy-1,3-dihydrobenzimidazol-2-ylidene)propanenitrile CAS Name: 2-(5-methoxy-1,3-dihydrobenzimidazol-2-ylidene)-3-(3-methoxy-4-oxo-5-prop-2-enyl-1-cyclohexa-2,5-dienylidene)propanenitrile IUPAC Name: 2-(5-methoxy-1,3-dihydrobenzimidazol-2-ylidene)-3-(3-methoxy-4-oxo-5-prop-2-enylcyclohexa-2,5-dien-1-ylidene)propanenitrile Traditional Name: 3-(3-allyl-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)-2-(5-methoxy-1,3-dihydrobenzimidazol-2-ylidene)propionitrile Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C(C=C3C=C(C(=O)C(=C3)OC)CC=C)C#N)N2

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C(C=C3C=C(C(=O)C(=C3)OC)CC=C)C#N)N2

InChI

InChI=1S/C21H19N3O3/c1-4-5-14-8-13(10-19(27-3)20(14)25)9-15(12-22)21-23-17-7-6-16(26-2)11-18(17)24-21/h4,6-11,23-24H,1,5H2,2-3H3