4-(dimethylamino)-2-[2-[[(4-nitrophenyl)methoxyamino]methylidene]pyrrol-1-ium-1-yl]pyridine-3-carbonitrile

Systemtic Name: 4-(dimethylamino)-2-[2-[[(4-nitrophenyl)methoxyamino]methylidene]pyrrol-1-ium-1-yl]pyridine-3-carbonitrile Openeye Name: 4-(dimethylamino)-2-[2-[[(4-nitrophenyl)methoxyamino]methylene]pyrrol-1-ium-1-yl]pyridine-3-carbonitrile CAS Name: 4-(dimethylamino)-2-[2-[[(4-nitrophenyl)methoxyamino]methylidene]-1-pyrrol-1-iumyl]-3-pyridinecarbonitrile IUPAC Name: 4-(dimethylamino)-2-[2-[[(4-nitrophenyl)methoxyamino]methylidene]pyrrol-1-ium-1-yl]pyridine-3-carbonitrile Traditional Name: 4-(dimethylamino)-2-[2-[[(4-nitrobenzyl)oxyamino]methylene]pyrrol-1-ium-1-yl]nicotinonitrile Formula: C20H19N6O3+ MolecularWeight: 391.40326

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=NC=C1)[N+]2=CC=CC2=CNOCC3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

CN(C)C1=C(C(=NC=C1)[N+]2=CC=CC2=CNOCC3=CC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H18N6O3/c1-24(2)19-9-10-22-20(18(19)12-21)25-11-3-4-17(25)13-23-29-14-15-5-7-16(8-6-15)26(27)28/h3-11,13H,14H2,1-2H3/p+1