(Z)-1-ethoxy-3-oxidanylidene-3-phenylazanyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)prop-1-en-1-olate

Systemtic Name: (Z)-1-ethoxy-3-oxidanylidene-3-phenylazanyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)prop-1-en-1-olate Openeye Name: (Z)-3-anilino-1-ethoxy-3-oxo-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]prop-1-en-1-olate CAS Name: (Z)-3-anilino-1-ethoxy-3-oxo-2-(4-pyridin-4-yl-1-pyridin-1-iumyl)-1-propen-1-olate IUPAC Name: (Z)-3-anilino-1-ethoxy-3-oxo-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)prop-1-en-1-olate Traditional Name: (Z)-3-anilino-1-ethoxy-3-keto-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]prop-1-en-1-olate Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)NC1=CC=CC=C1)[N+]2=CC=C(C=C2)C3=CC=NC=C3)[O-]

Isomeric SMILES

CCO/C(=C(/C(=O)NC1=CC=CC=C1)\[N+]2=CC=C(C=C2)C3=CC=NC=C3)/[O-]

InChI

InChI=1S/C21H19N3O3/c1-2-27-21(26)19(20(25)23-18-6-4-3-5-7-18)24-14-10-17(11-15-24)16-8-12-22-13-9-16/h3-15H,2H2,1H3,(H-,22,23,25,26)