N4-[1-(phenylmethyl)piperidin-4-yl]benzene-1,4-disulfonamide hydrochloride

Systemtic Name: N4-[1-(phenylmethyl)piperidin-4-yl]benzene-1,4-disulfonamide hydrochloride Openeye Name: N4-(1-benzyl-4-piperidyl)benzene-1,4-disulfonamide hydrochloride CAS Name: N4-[1-(phenylmethyl)-4-piperidinyl]benzene-1,4-disulfonamide hydrochloride IUPAC Name: 4-N-(1-benzylpiperidin-4-yl)benzene-1,4-disulfonamide hydrochloride Traditional Name: N'-(1-benzyl-4-piperidyl)benzene-1,4-disulfonamide hydrochloride Formula: C18H24ClN3O4S2 MolecularWeight: 445.98386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=CC=C3.Cl

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C18H23N3O4S2.ClH/c19-26(22,23)17-6-8-18(9-7-17)27(24,25)20-16-10-12-21(13-11-16)14-15-4-2-1-3-5-15;/h1-9,16,20H,10-14H2,(H2,19,22,23);1H