5-[4-oxidanyl-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: 5-[4-oxidanyl-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide Openeye Name: 5-[4-hydroxy-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-N-(2-thienylmethyl)benzofuran-2-carboxamide CAS Name: 5-[4-hydroxy-1-[(2S)-2-phenylpropyl]-4-piperidin-1-iumyl]-N-(thiophen-2-ylmethyl)-2-benzofurancarboxamide IUPAC Name: 5-[4-hydroxy-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide Traditional Name: 5-[4-hydroxy-1-[(2S)-2-phenylpropyl]piperidin-1-ium-4-yl]-N-(2-thenyl)coumarilamide Formula: C28H31N2O3S+ MolecularWeight: 475.62234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OC(=C3)C(=O)NCC4=CC=CS4)O)C5=CC=CC=C5

Isomeric SMILES

C[C@H](C[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OC(=C3)C(=O)NCC4=CC=CS4)O)C5=CC=CC=C5

InChI

InChI=1S/C28H30N2O3S/c1-20(21-6-3-2-4-7-21)19-30-13-11-28(32,12-14-30)23-9-10-25-22(16-23)17-26(33-25)27(31)29-18-24-8-5-15-34-24/h2-10,15-17,20,32H,11-14,18-19H2,1H3,(H,29,31)/p+1/t20-/m1/s1