2-chloranyl-N-cyclopentyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-cyclopentyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-cyclopentyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-cyclopentyl-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-cyclopentyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-cyclopentyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C18H27ClN3O3S+ MolecularWeight: 400.94328

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CCCC3

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CCCC3

InChI

InChI=1S/C18H26ClN3O3S/c1-2-21-9-11-22(12-10-21)26(24,25)15-7-8-17(19)16(13-15)18(23)20-14-5-3-4-6-14/h7-8,13-14H,2-6,9-12H2,1H3,(H,20,23)/p+1