N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]-3-piperidinosulfonyl-benzamide Formula: C24H33N4O3S+ MolecularWeight: 457.60882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H32N4O3S/c29-24(21-8-7-11-23(20-21)32(30,31)28-13-5-2-6-14-28)25-12-15-26-16-18-27(19-17-26)22-9-3-1-4-10-22/h1,3-4,7-11,20H,2,5-6,12-19H2,(H,25,29)/p+1