cyclohexyl 2-ethyl-3-ethylperoxycarbonyl-5-(furan-2-ylcarbonylamino)-6-[1-(4-methylphenyl)piperidin-1-ium-1-yl]benzoate

Systemtic Name: cyclohexyl 2-ethyl-3-ethylperoxycarbonyl-5-(furan-2-ylcarbonylamino)-6-[1-(4-methylphenyl)piperidin-1-ium-1-yl]benzoate Openeye Name: cyclohexyl 2-ethyl-3-ethylperoxycarbonyl-5-(furan-2-carbonylamino)-6-[1-(p-tolyl)piperidin-1-ium-1-yl]benzoate CAS Name: 2-ethyl-3-[ethyldioxy(oxo)methyl]-5-[[2-furanyl(oxo)methyl]amino]-6-[1-(4-methylphenyl)-1-piperidin-1-iumyl]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-ethyl-3-ethylperoxycarbonyl-5-(furan-2-carbonylamino)-6-[1-(4-methylphenyl)piperidin-1-ium-1-yl]benzoate Traditional Name: 2-ethyl-3-ethylperoxycarbonyl-5-(2-furoylamino)-6-[1-(p-tolyl)piperidin-1-ium-1-yl]benzoic acid cyclohexyl ester Formula: C35H43N2O7+ MolecularWeight: 603.72512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1C(=O)OOCC)NC(=O)C2=CC=CO2)[N+]3(CCCCC3)C4=CC=C(C=C4)C)C(=O)OC5CCCCC5

Isomeric SMILES

CCC1=C(C(=C(C=C1C(=O)OOCC)NC(=O)C2=CC=CO2)[N+]3(CCCCC3)C4=CC=C(C=C4)C)C(=O)OC5CCCCC5

InChI

InChI=1S/C35H42N2O7/c1-4-27-28(34(39)44-42-5-2)23-29(36-33(38)30-15-12-22-41-30)32(31(27)35(40)43-26-13-8-6-9-14-26)37(20-10-7-11-21-37)25-18-16-24(3)17-19-25/h12,15-19,22-23,26H,4-11,13-14,20-21H2,1-3H3/p+1