(2R)-2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclopentyl-propanamide

Systemtic Name: (2R)-2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclopentyl-propanamide Openeye Name: (2R)-2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclopentyl-propanamide CAS Name: (2R)-2-[4-(3-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-cyclopentylpropanamide IUPAC Name: (2R)-2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclopentylpropanamide Traditional Name: (2R)-2-[4-(3-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-cyclopentyl-propionamide Formula: C18H27ClN3O3S+ MolecularWeight: 400.94328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C[C@H](C(=O)NC1CCCC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H26ClN3O3S/c1-14(18(23)20-16-6-2-3-7-16)21-9-11-22(12-10-21)26(24,25)17-8-4-5-15(19)13-17/h4-5,8,13-14,16H,2-3,6-7,9-12H2,1H3,(H,20,23)/p+1/t14-/m1/s1