6-(1-butyl-1,3-dihydrobenzimidazol-1-ium-2-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 6-(1-butyl-1,3-dihydrobenzimidazol-1-ium-2-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 6-(1-butyl-1,3-dihydrobenzimidazol-1-ium-2-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 6-(1-butyl-1,3-dihydrobenzimidazol-1-ium-2-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 6-(1-butyl-1,3-dihydrobenzimidazol-1-ium-2-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 6-(1-butyl-1,3-dihydrobenzimidazol-1-ium-2-ylidene)cyclohexa-2,4-dien-1-one Formula: C17H19N2O+ MolecularWeight: 267.34556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]1C2=CC=CC=C2NC1=C3C=CC=CC3=O

Isomeric SMILES

CCCC[NH+]1C2=CC=CC=C2NC1=C3C=CC=CC3=O

InChI

InChI=1S/C17H18N2O/c1-2-3-12-19-15-10-6-5-9-14(15)18-17(19)13-8-4-7-11-16(13)20/h4-11,18H,2-3,12H2,1H3/p+1