N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanamide

Systemtic Name: N-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanamide Openeye Name: N-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-2-(4-ethylpiperazine-1,4-diium-1-yl)acetamide CAS Name: N-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-2-(4-ethyl-1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-2-(4-ethylpiperazine-1,4-diium-1-yl)acetamide Traditional Name: N-(2-chloro-5-piperidinosulfonyl-phenyl)-2-(4-ethylpiperazine-1,4-diium-1-yl)acetamide Formula: C19H31ClN4O3S+2 MolecularWeight: 430.99244

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C19H29ClN4O3S/c1-2-22-10-12-23(13-11-22)15-19(25)21-18-14-16(6-7-17(18)20)28(26,27)24-8-4-3-5-9-24/h6-7,14H,2-5,8-13,15H2,1H3,(H,21,25)/p+2