(E)-azanyl-[5-methoxy-1,3-bis(oxidanylidene)inden-2-ylidene]-pyridin-4-ylcarbonyl-azanium

Systemtic Name: (E)-azanyl-[5-methoxy-1,3-bis(oxidanylidene)inden-2-ylidene]-pyridin-4-ylcarbonyl-azanium Openeye Name: (E)-amino-(5-methoxy-1,3-dioxo-indan-2-ylidene)-(pyridine-4-carbonyl)ammonium CAS Name: (E)-amino-(5-methoxy-1,3-dioxo-2-indenylidene)-[oxo(pyridin-4-yl)methyl]ammonium IUPAC Name: (E)-amino-(5-methoxy-1,3-dioxoinden-2-ylidene)-(pyridine-4-carbonyl)azanium Traditional Name: (E)-amino-(1,3-diketo-5-methoxy-indan-2-ylidene)-isonicotinoyl-ammonium Formula: C16H12N3O4+ MolecularWeight: 310.28418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=[N+](C(=O)C3=CC=NC=C3)N)C2=O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)/C(=[N+](/C(=O)C3=CC=NC=C3)\N)/C2=O

InChI

InChI=1S/C16H11N3O4/c1-23-10-2-3-11-12(8-10)15(21)13(14(11)20)19(17)16(22)9-4-6-18-7-5-9/h2-8H,1H3,(H-,17,20,21)/p+1