6-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-3-methyl-1,3-benzoxazol-2-one

Systemtic Name: 6-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-3-methyl-1,3-benzoxazol-2-one Openeye Name: 6-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-3-methyl-1,3-benzoxazol-2-one CAS Name: 6-[(4-cyclohexyl-1-piperazin-4-iumyl)sulfonyl]-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 6-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-3-methyl-1,3-benzoxazol-2-one Traditional Name: 6-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-3-methyl-1,3-benzoxazol-2-one Formula: C18H26N3O4S+ MolecularWeight: 380.48174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C4CCCCC4)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)C4CCCCC4)OC1=O

InChI

InChI=1S/C18H25N3O4S/c1-19-16-8-7-15(13-17(16)25-18(19)22)26(23,24)21-11-9-20(10-12-21)14-5-3-2-4-6-14/h7-8,13-14H,2-6,9-12H2,1H3/p+1