N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-(1-cyclohexenyl)-N-cyclopropyl-2-[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C21H29FN3O3S+ MolecularWeight: 422.536663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)N(C2CC2)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CCC(=CC1)N(C2CC2)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C21H28FN3O3S/c22-17-5-4-8-20(15-17)29(27,28)24-13-11-23(12-14-24)16-21(26)25(19-9-10-19)18-6-2-1-3-7-18/h4-6,8,15,19H,1-3,7,9-14,16H2/p+1