butyl-[[6-oxidanylidene-3-(1H-pyrazin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]-(phenylmethyl)azanium

Systemtic Name: butyl-[[6-oxidanylidene-3-(1H-pyrazin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]-(phenylmethyl)azanium Openeye Name: benzyl-butyl-[[6-oxo-3-(1H-pyrazin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]ammonium CAS Name: butyl-[[6-oxo-3-(1H-pyrazin-2-ylidene)-1-cyclohexa-1,4-dienyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-butyl-[[6-oxo-3-(1H-pyrazin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]azanium Traditional Name: benzyl-butyl-[[6-keto-3-(1H-pyrazin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]ammonium Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=CC=C1)CC2=CC(=C3C=NC=CN3)C=CC2=O

Isomeric SMILES

CCCC[NH+](CC1=CC=CC=C1)CC2=CC(=C3C=NC=CN3)C=CC2=O

InChI

InChI=1S/C22H25N3O/c1-2-3-13-25(16-18-7-5-4-6-8-18)17-20-14-19(9-10-22(20)26)21-15-23-11-12-24-21/h4-12,14-15,24H,2-3,13,16-17H2,1H3/p+1