11-oxidanylidene-5-prop-2-enyl-8,9,10,10a-tetrahydro-7H-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile

Systemtic Name: 11-oxidanylidene-5-prop-2-enyl-8,9,10,10a-tetrahydro-7H-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile Openeye Name: 5-allyl-11-oxo-8,9,10,10a-tetrahydro-7H-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile CAS Name: 11-oxo-5-prop-2-enyl-8,9,10,10a-tetrahydro-7H-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile IUPAC Name: 11-oxo-5-prop-2-enyl-8,9,10,10a-tetrahydro-7H-benzimidazolo[1,2-b]isoquinolin-5-ium-6-carbonitrile Traditional Name: 5-allyl-11-keto-8,9,10,10a-tetrahydro-7H-benzimidazol[1,2-b]isoquinolin-5-ium-6-carbonitrile Formula: C19H18N3O+ MolecularWeight: 304.36572

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C2C(=C3CCCCC3C(=O)N2C4=CC=CC=C41)C#N

Isomeric SMILES

C=CC[N+]1=C2C(=C3CCCCC3C(=O)N2C4=CC=CC=C41)C#N

InChI

InChI=1S/C19H18N3O/c1-2-11-21-16-9-5-6-10-17(16)22-18(21)15(12-20)13-7-3-4-8-14(13)19(22)23/h2,5-6,9-10,14H,1,3-4,7-8,11H2/q+1