N-(3-ethynylphenyl)-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-(3-ethynylphenyl)-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-(3-ethynylphenyl)-3,4-dimethoxy-benzenesulfonamide CAS Name: N-(3-ethynylphenyl)-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-(3-ethynylphenyl)-3,4-dimethoxybenzenesulfonamide Traditional Name: N-(3-ethynylphenyl)-3,4-dimethoxy-benzenesulfonamide Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#C)OC

InChI

InChI=1S/C16H15NO4S/c1-4-12-6-5-7-13(10-12)17-22(18,19)14-8-9-15(20-2)16(11-14)21-3/h1,5-11,17H,2-3H3