N1-(3-ethynylphenyl)-N4,N4-dimethyl-benzene-1,4-disulfonamide

Systemtic Name: N1-(3-ethynylphenyl)-N4,N4-dimethyl-benzene-1,4-disulfonamide Openeye Name: N1-(3-ethynylphenyl)-N4,N4-dimethyl-benzene-1,4-disulfonamide CAS Name: N1-(3-ethynylphenyl)-N4,N4-dimethylbenzene-1,4-disulfonamide IUPAC Name: 1-N-(3-ethynylphenyl)-4-N,4-N-dimethylbenzene-1,4-disulfonamide Traditional Name: N-(3-ethynylphenyl)-N',N'-dimethyl-benzene-1,4-disulfonamide Formula: C16H16N2O4S2 MolecularWeight: 364.43924

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C16H16N2O4S2/c1-4-13-6-5-7-14(12-13)17-23(19,20)15-8-10-16(11-9-15)24(21,22)18(2)3/h1,5-12,17H,2-3H3