1-[1-[(E)-4-[4-(nitrosomethylidene)pyridin-1-yl]but-2-enyl]pyridin-1-ium-4-yl]ethanone

Systemtic Name: 1-[1-[(E)-4-[4-(nitrosomethylidene)pyridin-1-yl]but-2-enyl]pyridin-1-ium-4-yl]ethanone Openeye Name: 1-[1-[(E)-4-[4-(nitrosomethylene)-1-pyridyl]but-2-enyl]pyridin-1-ium-4-yl]ethanone CAS Name: 1-[1-[(E)-4-[4-(nitrosomethylidene)-1-pyridinyl]but-2-enyl]-4-pyridin-1-iumyl]ethanone IUPAC Name: 1-[1-[(E)-4-[4-(nitrosomethylidene)pyridin-1-yl]but-2-enyl]pyridin-1-ium-4-yl]ethanone Traditional Name: 1-[1-[(E)-4-[4-(nitrosomethylene)-1-pyridyl]but-2-enyl]pyridin-1-ium-4-yl]ethanone Formula: C17H18N3O2+ MolecularWeight: 296.34372

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=[N+](C=C1)CC=CCN2C=CC(=CN=O)C=C2

Isomeric SMILES

CC(=O)C1=CC=[N+](C=C1)C/C=C/CN2C=CC(=CN=O)C=C2

InChI

InChI=1S/C17H18N3O2/c1-15(21)17-6-12-20(13-7-17)9-3-2-8-19-10-4-16(5-11-19)14-18-22/h2-7,10-14H,8-9H2,1H3/q+1/b3-2+