N4-methyl-N4-(phenylmethyl)-N1-(2-piperidin-1-ylethyl)benzene-1,4-disulfonamide

Systemtic Name: N4-methyl-N4-(phenylmethyl)-N1-(2-piperidin-1-ylethyl)benzene-1,4-disulfonamide Openeye Name: N4-benzyl-N4-methyl-N1-[2-(1-piperidyl)ethyl]benzene-1,4-disulfonamide CAS Name: N4-methyl-N4-(phenylmethyl)-N1-[2-(1-piperidinyl)ethyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-benzyl-4-N-methyl-1-N-(2-piperidin-1-ylethyl)benzene-1,4-disulfonamide Traditional Name: N'-benzyl-N'-methyl-N-(2-piperidinoethyl)benzene-1,4-disulfonamide Formula: C21H29N3O4S2 MolecularWeight: 451.60266

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCCN3CCCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NCCN3CCCCC3

InChI

InChI=1S/C21H29N3O4S2/c1-23(18-19-8-4-2-5-9-19)30(27,28)21-12-10-20(11-13-21)29(25,26)22-14-17-24-15-6-3-7-16-24/h2,4-5,8-13,22H,3,6-7,14-18H2,1H3