N-methyl-5-(4-oxidanyl-1-propyl-piperidin-1-ium-4-yl)-N-(quinolin-8-ylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-methyl-5-(4-oxidanyl-1-propyl-piperidin-1-ium-4-yl)-N-(quinolin-8-ylmethyl)-1-benzofuran-2-carboxamide Openeye Name: 5-(4-hydroxy-1-propyl-piperidin-1-ium-4-yl)-N-methyl-N-(8-quinolylmethyl)benzofuran-2-carboxamide CAS Name: 5-(4-hydroxy-1-propyl-4-piperidin-1-iumyl)-N-methyl-N-(8-quinolinylmethyl)-2-benzofurancarboxamide IUPAC Name: 5-(4-hydroxy-1-propylpiperidin-1-ium-4-yl)-N-methyl-N-(quinolin-8-ylmethyl)-1-benzofuran-2-carboxamide Traditional Name: 5-(4-hydroxy-1-propyl-piperidin-1-ium-4-yl)-N-methyl-N-(8-quinolylmethyl)coumarilamide Formula: C28H32N3O3+ MolecularWeight: 458.57198

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OC(=C3)C(=O)N(C)CC4=CC=CC5=C4N=CC=C5)O

Isomeric SMILES

CCC[NH+]1CCC(CC1)(C2=CC3=C(C=C2)OC(=C3)C(=O)N(C)CC4=CC=CC5=C4N=CC=C5)O

InChI

InChI=1S/C28H31N3O3/c1-3-14-31-15-11-28(33,12-16-31)23-9-10-24-22(17-23)18-25(34-24)27(32)30(2)19-21-7-4-6-20-8-5-13-29-26(20)21/h4-10,13,17-18,33H,3,11-12,14-16,19H2,1-2H3/p+1