3-[2-(3-methylimidazol-4-yl)ethynyl]xanthen-9-one

Systemtic Name: 3-[2-(3-methylimidazol-4-yl)ethynyl]xanthen-9-one Openeye Name: 3-[2-(3-methylimidazol-4-yl)ethynyl]xanthen-9-one CAS Name: 3-[2-(3-methyl-4-imidazolyl)ethynyl]-9-xanthenone IUPAC Name: 3-[2-(3-methylimidazol-4-yl)ethynyl]xanthen-9-one Traditional Name: 3-[2-(3-methylimidazol-4-yl)ethynyl]xanthone Formula: C19H12N2O2 MolecularWeight: 300.31078

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C#CC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4O3

Isomeric SMILES

CN1C=NC=C1C#CC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C19H12N2O2/c1-21-12-20-11-14(21)8-6-13-7-9-16-18(10-13)23-17-5-3-2-4-15(17)19(16)22/h2-5,7,9-12H,1H3