2-(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(5-hydroxy-4-oxo-2-phenyl-chromen-7-yl)oxy-acetamide CAS Name: 2-[(5-hydroxy-4-oxo-2-phenyl-1-benzopyran-7-yl)oxy]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(5-hydroxy-4-keto-2-phenyl-chromen-7-yl)oxy-acetamide Formula: C29H29N2O5+ MolecularWeight: 485.55096

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)COC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1NC(=O)COC2=CC(=C3C(=C2)OC(=CC3=O)C4=CC=CC=C4)O)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N2O5/c32-24-15-23(16-27-29(24)25(33)17-26(36-27)21-9-5-2-6-10-21)35-19-28(34)30-22-11-13-31(14-12-22)18-20-7-3-1-4-8-20/h1-10,15-17,22,32H,11-14,18-19H2,(H,30,34)/p+1