1-[4-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]butyl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-[4-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]butyl]pyridin-1-ium-4-carboxamide Openeye Name: 1-[4-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]butyl]pyridin-1-ium-4-carboxamide CAS Name: 1-[4-[3-[(E)-hydroxyiminomethyl]-1-pyridin-1-iumyl]butyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-[4-[3-[(E)-hydroxyiminomethyl]pyridin-1-ium-1-yl]butyl]pyridin-1-ium-4-carboxamide Traditional Name: 1-[4-[3-[(E)-hydroximinomethyl]pyridin-1-ium-1-yl]butyl]pyridin-1-ium-4-carboxamide Formula: C16H20N4O2+2 MolecularWeight: 300.3556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CCCC[N+]2=CC=C(C=C2)C(=O)N)C=NO

Isomeric SMILES

C1=CC(=C[N+](=C1)CCCC[N+]2=CC=C(C=C2)C(=O)N)/C=N/O

InChI

InChI=1S/C16H18N4O2/c17-16(21)15-5-10-19(11-6-15)7-1-2-8-20-9-3-4-14(13-20)12-18-22/h3-6,9-13H,1-2,7-8H2,(H-2,17,21,22)/p+2/b18-12+