N-(9-ethylcarbazol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(9-ethylcarbazol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(9-ethylcarbazol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-(9-ethyl-3-carbazolyl)-2-[4-(2-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(9-ethylcarbazol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-(9-ethylcarbazol-3-yl)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C26H28FN4O3S+ MolecularWeight: 495.588923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)C5=CC=CC=C51

InChI

InChI=1S/C26H27FN4O3S/c1-2-31-23-9-5-3-7-20(23)21-17-19(11-12-24(21)31)28-26(32)18-29-13-15-30(16-14-29)35(33,34)25-10-6-4-8-22(25)27/h3-12,17H,2,13-16,18H2,1H3,(H,28,32)/p+1