N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(4-ethoxyphenyl)methyl]-N1-(phenylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(4-ethoxyphenyl)methyl]-N1-(phenylmethyl)benzene-1,4-disulfonamide Openeye Name: N4-(1,3-benzodioxol-5-ylmethyl)-N1-benzyl-N4-[(4-ethoxyphenyl)methyl]benzene-1,4-disulfonamide CAS Name: N4-(1,3-benzodioxol-5-ylmethyl)-N4-[(4-ethoxyphenyl)methyl]-N1-(phenylmethyl)benzene-1,4-disulfonamide IUPAC Name: 4-N-(1,3-benzodioxol-5-ylmethyl)-1-N-benzyl-4-N-[(4-ethoxyphenyl)methyl]benzene-1,4-disulfonamide Traditional Name: N-benzyl-N'-(4-ethoxybenzyl)-N'-piperonyl-benzene-1,4-disulfonamide Formula: C30H30N2O7S2 MolecularWeight: 594.6984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)NCC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C30H30N2O7S2/c1-2-37-26-11-8-24(9-12-26)20-32(21-25-10-17-29-30(18-25)39-22-38-29)41(35,36)28-15-13-27(14-16-28)40(33,34)31-19-23-6-4-3-5-7-23/h3-18,31H,2,19-22H2,1H3