[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]-[(4-ethylphenyl)methyl]-methyl-azanium

Systemtic Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl]-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C21H23N4O+ MolecularWeight: 347.43352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)C(=C2NC3=CC=CC=C3N2)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C21H22N4O/c1-3-15-8-10-16(11-9-15)13-25(2)14-20(26)17(12-22)21-23-18-6-4-5-7-19(18)24-21/h4-11,23-24H,3,13-14H2,1-2H3/p+1