6-[2-(4-aminophenyl)ethynyl]-1-methoxy-xanthen-9-one

Systemtic Name: 6-[2-(4-aminophenyl)ethynyl]-1-methoxy-xanthen-9-one Openeye Name: 6-[2-(4-aminophenyl)ethynyl]-1-methoxy-xanthen-9-one CAS Name: 6-[2-(4-aminophenyl)ethynyl]-1-methoxy-9-xanthenone IUPAC Name: 6-[2-(4-aminophenyl)ethynyl]-1-methoxyxanthen-9-one Traditional Name: 6-[2-(4-aminophenyl)ethynyl]-1-methoxy-xanthone Formula: C22H15NO3 MolecularWeight: 341.3594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=O)C3=C(O2)C=C(C=C3)C#CC4=CC=C(C=C4)N

Isomeric SMILES

COC1=CC=CC2=C1C(=O)C3=C(O2)C=C(C=C3)C#CC4=CC=C(C=C4)N

InChI

InChI=1S/C22H15NO3/c1-25-18-3-2-4-19-21(18)22(24)17-12-9-15(13-20(17)26-19)6-5-14-7-10-16(23)11-8-14/h2-4,7-13H,23H2,1H3