2-(2-methoxyphenyl)ethyl-[[6-oxidanylidene-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]azanium

Systemtic Name: 2-(2-methoxyphenyl)ethyl-[[6-oxidanylidene-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]azanium Openeye Name: 2-(2-methoxyphenyl)ethyl-[[6-oxo-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]ammonium CAS Name: 2-(2-methoxyphenyl)ethyl-[[6-oxo-3-(1H-pyridin-2-ylidene)-1-cyclohexa-1,4-dienyl]methyl]ammonium IUPAC Name: 2-(2-methoxyphenyl)ethyl-[[6-oxo-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl]azanium Traditional Name: [6-keto-3-(1H-pyridin-2-ylidene)cyclohexa-1,4-dien-1-yl]methyl-[2-(2-methoxyphenyl)ethyl]ammonium Formula: C21H23N2O2+ MolecularWeight: 335.41952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC[NH2+]CC2=CC(=C3C=CC=CN3)C=CC2=O

Isomeric SMILES

COC1=CC=CC=C1CC[NH2+]CC2=CC(=C3C=CC=CN3)C=CC2=O

InChI

InChI=1S/C21H22N2O2/c1-25-21-8-3-2-6-16(21)11-13-22-15-18-14-17(9-10-20(18)24)19-7-4-5-12-23-19/h2-10,12,14,22-23H,11,13,15H2,1H3/p+1