N4-cyclopropyl-N4-[(2,3-dimethoxyphenyl)methyl]-N1,N1-diethyl-benzene-1,4-disulfonamide

Systemtic Name: N4-cyclopropyl-N4-[(2,3-dimethoxyphenyl)methyl]-N1,N1-diethyl-benzene-1,4-disulfonamide Openeye Name: N4-cyclopropyl-N4-[(2,3-dimethoxyphenyl)methyl]-N1,N1-diethyl-benzene-1,4-disulfonamide CAS Name: N4-cyclopropyl-N4-[(2,3-dimethoxyphenyl)methyl]-N1,N1-diethylbenzene-1,4-disulfonamide IUPAC Name: 4-N-cyclopropyl-4-N-[(2,3-dimethoxyphenyl)methyl]-1-N,1-N-diethylbenzene-1,4-disulfonamide Traditional Name: N'-cyclopropyl-N,N-diethyl-N'-o-veratryl-benzene-1,4-disulfonamide Formula: C22H30N2O6S2 MolecularWeight: 482.6134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C(=CC=C2)OC)OC)C3CC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC2=C(C(=CC=C2)OC)OC)C3CC3

InChI

InChI=1S/C22H30N2O6S2/c1-5-23(6-2)31(25,26)19-12-14-20(15-13-19)32(27,28)24(18-10-11-18)16-17-8-7-9-21(29-3)22(17)30-4/h7-9,12-15,18H,5-6,10-11,16H2,1-4H3