N4-cyclopentyl-N4-[(3-methoxyphenyl)methyl]-N1-(phenylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-cyclopentyl-N4-[(3-methoxyphenyl)methyl]-N1-(phenylmethyl)benzene-1,4-disulfonamide Openeye Name: N1-benzyl-N4-cyclopentyl-N4-[(3-methoxyphenyl)methyl]benzene-1,4-disulfonamide CAS Name: N4-cyclopentyl-N4-[(3-methoxyphenyl)methyl]-N1-(phenylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-benzyl-4-N-cyclopentyl-4-N-[(3-methoxyphenyl)methyl]benzene-1,4-disulfonamide Traditional Name: N-benzyl-N'-cyclopentyl-N'-m-anisyl-benzene-1,4-disulfonamide Formula: C26H30N2O5S2 MolecularWeight: 514.6568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(C2CCCC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CN(C2CCCC2)S(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O5S2/c1-33-24-13-7-10-22(18-24)20-28(23-11-5-6-12-23)35(31,32)26-16-14-25(15-17-26)34(29,30)27-19-21-8-3-2-4-9-21/h2-4,7-10,13-18,23,27H,5-6,11-12,19-20H2,1H3