2-(3-pyridin-4-yloxyprop-1-ynyl)-1H-quinazolin-4-one

Systemtic Name: 2-(3-pyridin-4-yloxyprop-1-ynyl)-1H-quinazolin-4-one Openeye Name: 2-[3-(4-pyridyloxy)prop-1-ynyl]-1H-quinazolin-4-one CAS Name: 2-(3-pyridin-4-yloxyprop-1-ynyl)-1H-quinazolin-4-one IUPAC Name: 2-(3-pyridin-4-yloxyprop-1-ynyl)-1H-quinazolin-4-one Traditional Name: 2-[3-(4-pyridyloxy)prop-1-ynyl]-1H-quinazolin-4-one Formula: C16H11N3O2 MolecularWeight: 277.27744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C#CCOC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C#CCOC3=CC=NC=C3

InChI

InChI=1S/C16H11N3O2/c20-16-13-4-1-2-5-14(13)18-15(19-16)6-3-11-21-12-7-9-17-10-8-12/h1-2,4-5,7-10H,11H2,(H,18,19,20)