1-[4-[(2E)-2-(nitrosomethylidene)pyridin-1-yl]butyl]pyridin-1-ium-4-carboxamide

Systemtic Name: 1-[4-[(2E)-2-(nitrosomethylidene)pyridin-1-yl]butyl]pyridin-1-ium-4-carboxamide Openeye Name: 1-[4-[(2E)-2-(nitrosomethylene)-1-pyridyl]butyl]pyridin-1-ium-4-carboxamide CAS Name: 1-[4-[(2E)-2-(nitrosomethylidene)-1-pyridinyl]butyl]-4-pyridin-1-iumcarboxamide IUPAC Name: 1-[4-[(2E)-2-(nitrosomethylidene)pyridin-1-yl]butyl]pyridin-1-ium-4-carboxamide Traditional Name: 1-[4-[(2E)-2-(nitrosomethylene)-1-pyridyl]butyl]pyridin-1-ium-4-carboxamide Formula: C16H19N4O2+ MolecularWeight: 299.34766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O2/c17-16(21)14-6-11-19(12-7-14)8-3-4-10-20-9-2-1-5-15(20)13-18-22/h1-2,5-7,9,11-13H,3-4,8,10H2,(H-,17,21)/p+1/b15-13+