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

Systemtic Name: 2-(4-butyl-2-oxidanylidene-chromen-7-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-butyl-2-oxo-chromen-7-yl)oxy-acetamide CAS Name: 2-[(4-butyl-2-oxo-1-benzopyran-7-yl)oxy]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-butyl-2-oxochromen-7-yl)oxyacetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-butyl-2-keto-chromen-7-yl)oxy-acetamide Formula: C27H33N2O4+ MolecularWeight: 449.56192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O4/c1-2-3-9-21-16-27(31)33-25-17-23(10-11-24(21)25)32-19-26(30)28-22-12-14-29(15-13-22)18-20-7-5-4-6-8-20/h4-8,10-11,16-17,22H,2-3,9,12-15,18-19H2,1H3,(H,28,30)/p+1