2-(4-oxidanylidene-3-phenyl-chromen-7-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3-phenyl-chromen-7-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-oxo-3-phenyl-chromen-7-yl)oxy-acetamide CAS Name: 2-[(4-oxo-3-phenyl-1-benzopyran-7-yl)oxy]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-keto-3-phenyl-chromen-7-yl)oxy-acetamide Formula: C29H29N2O4+ MolecularWeight: 469.55156

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)COC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1NC(=O)COC2=CC3=C(C=C2)C(=O)C(=CO3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N2O4/c32-28(30-23-13-15-31(16-14-23)18-21-7-3-1-4-8-21)20-34-24-11-12-25-27(17-24)35-19-26(29(25)33)22-9-5-2-6-10-22/h1-12,17,19,23H,13-16,18,20H2,(H,30,32)/p+1