dimethyl-[[2-oxidanylidene-3-(pyridin-3-ylamino)indol-1-ium-1-yl]methyl]azanium

Systemtic Name: dimethyl-[[2-oxidanylidene-3-(pyridin-3-ylamino)indol-1-ium-1-yl]methyl]azanium Openeye Name: dimethyl-[[2-oxo-3-(3-pyridylamino)indol-1-ium-1-yl]methyl]ammonium CAS Name: dimethyl-[[2-oxo-3-(3-pyridinylamino)-1-indol-1-iumyl]methyl]ammonium IUPAC Name: dimethyl-[[2-oxo-3-(pyridin-3-ylamino)indol-1-ium-1-yl]methyl]azanium Traditional Name: [2-keto-3-(3-pyridylamino)indol-1-ium-1-yl]methyl-dimethyl-ammonium Formula: C16H18N4O+2 MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C[N+]1=C2C=CC=CC2=C(C1=O)NC3=CN=CC=C3

Isomeric SMILES

C[NH+](C)C[N+]1=C2C=CC=CC2=C(C1=O)NC3=CN=CC=C3

InChI

InChI=1S/C16H16N4O/c1-19(2)11-20-14-8-4-3-7-13(14)15(16(20)21)18-12-6-5-9-17-10-12/h3-10H,11H2,1-2H3/p+2