N4,N4-diethyl-N1-prop-2-ynyl-benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-prop-2-ynyl-benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-prop-2-ynyl-benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-prop-2-ynylbenzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-prop-2-ynylbenzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-propargyl-benzene-1,4-disulfonamide Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC#C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NCC#C

InChI

InChI=1S/C13H18N2O4S2/c1-4-11-14-20(16,17)12-7-9-13(10-8-12)21(18,19)15(5-2)6-3/h1,7-10,14H,5-6,11H2,2-3H3