3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-ethynylphenyl)propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-ethynylphenyl)propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-ethynylphenyl)propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-ethynylphenyl)propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-ethynylphenyl)propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(3-ethynylphenyl)propionamide Formula: C19H17NO5S MolecularWeight: 371.40698

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H17NO5S/c1-2-14-4-3-5-15(12-14)20-19(21)8-11-26(22,23)16-6-7-17-18(13-16)25-10-9-24-17/h1,3-7,12-13H,8-11H2,(H,20,21)