N-(3-ethynylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-(3-ethynylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-(3-ethynylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-(3-ethynylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-(3-ethynylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-(3-ethynylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C17H13NO3 MolecularWeight: 279.29002

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)C2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H13NO3/c1-2-12-6-5-7-13(10-12)18-17(19)16-11-20-14-8-3-4-9-15(14)21-16/h1,3-10,16H,11H2,(H,18,19)