2-(4-oxidanylidenechromeno[4,3-c]pyrazol-1-yl)-N-pyridin-1-ium-2-yl-ethanamide

Systemtic Name: 2-(4-oxidanylidenechromeno[4,3-c]pyrazol-1-yl)-N-pyridin-1-ium-2-yl-ethanamide Openeye Name: 2-(4-oxochromeno[4,3-c]pyrazol-1-yl)-N-pyridin-1-ium-2-yl-acetamide CAS Name: 2-(4-oxo-1-[1]benzopyrano[4,3-c]pyrazolyl)-N-(2-pyridin-1-iumyl)acetamide IUPAC Name: 2-(4-oxochromeno[4,3-c]pyrazol-1-yl)-N-pyridin-1-ium-2-ylacetamide Traditional Name: 2-(4-ketochromeno[4,3-c]pyrazol-1-yl)-N-pyridin-1-ium-2-yl-acetamide Formula: C17H13N4O3+ MolecularWeight: 321.31012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=NN3CC(=O)NC4=CC=CC=[NH+]4)C(=O)O2

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=NN3CC(=O)NC4=CC=CC=[NH+]4)C(=O)O2

InChI

InChI=1S/C17H12N4O3/c22-15(20-14-7-3-4-8-18-14)10-21-16-11-5-1-2-6-13(11)24-17(23)12(16)9-19-21/h1-9H,10H2,(H,18,20,22)/p+1