N-cyclohexyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-5-oxidanyl-1-benzofuran-3-carboxamide

Systemtic Name: N-cyclohexyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-2-methyl-5-oxidanyl-1-benzofuran-3-carboxamide Openeye Name: N-cyclohexyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-5-hydroxy-2-methyl-benzofuran-3-carboxamide CAS Name: N-cyclohexyl-4-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]-5-hydroxy-2-methyl-3-benzofurancarboxamide IUPAC Name: N-cyclohexyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide Traditional Name: N-cyclohexyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]-5-hydroxy-2-methyl-benzofuran-3-carboxamide Formula: C24H35N2O3+ MolecularWeight: 399.5463

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4CCCCC4)O

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=C(C=CC3=C2C(=C(O3)C)C(=O)NC4CCCCC4)O

InChI

InChI=1S/C24H34N2O3/c1-3-18-11-7-8-14-26(18)15-19-20(27)12-13-21-23(19)22(16(2)29-21)24(28)25-17-9-5-4-6-10-17/h12-13,17-18,27H,3-11,14-15H2,1-2H3,(H,25,28)/p+1/t18-/m0/s1