3-(3-oxidanylpropyl)-7-(2-pyridin-3-ylethynyl)isochromen-1-one

Systemtic Name: 3-(3-oxidanylpropyl)-7-(2-pyridin-3-ylethynyl)isochromen-1-one Openeye Name: 3-(3-hydroxypropyl)-7-[2-(3-pyridyl)ethynyl]isochromen-1-one CAS Name: 3-(3-hydroxypropyl)-7-[2-(3-pyridinyl)ethynyl]-2-benzopyran-1-one IUPAC Name: 3-(3-hydroxypropyl)-7-(2-pyridin-3-ylethynyl)isochromen-1-one Traditional Name: 3-(3-hydroxypropyl)-7-[2-(3-pyridyl)ethynyl]isocoumarin Formula: C19H15NO3 MolecularWeight: 305.3273

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C#CC2=CC3=C(C=C2)C=C(OC3=O)CCCO

Isomeric SMILES

C1=CC(=CN=C1)C#CC2=CC3=C(C=C2)C=C(OC3=O)CCCO

InChI

InChI=1S/C19H15NO3/c21-10-2-4-17-12-16-8-7-14(11-18(16)19(22)23-17)5-6-15-3-1-9-20-13-15/h1,3,7-9,11-13,21H,2,4,10H2