(1R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]cyclohex-3-ene-1-carboxamide

Systemtic Name: (1R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]cyclohex-3-ene-1-carboxamide Openeye Name: (1R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]cyclohex-3-ene-1-carboxamide CAS Name: (1R)-N-[4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-1-cyclohex-3-enecarboxamide IUPAC Name: (1R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]cyclohex-3-ene-1-carboxamide Traditional Name: (1R)-N-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]cyclohex-3-ene-1-carboxamide Formula: C19H28N3O3S+ MolecularWeight: 378.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCC=CC3

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CCC=CC3

InChI

InChI=1S/C19H27N3O3S/c1-2-21-12-14-22(15-13-21)26(24,25)18-10-8-17(9-11-18)20-19(23)16-6-4-3-5-7-16/h3-4,8-11,16H,2,5-7,12-15H2,1H3,(H,20,23)/p+1/t16-/m0/s1