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

Systemtic Name: 2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4,7-dimethyl-2-oxo-chromen-5-yl)oxy-acetamide CAS Name: 2-[(4,7-dimethyl-2-oxo-1-benzopyran-5-yl)oxy]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4,7-dimethyl-2-oxochromen-5-yl)oxyacetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2-keto-4,7-dimethyl-chromen-5-yl)oxy-acetamide Formula: C25H29N2O4+ MolecularWeight: 421.50876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O4/c1-17-12-21(25-18(2)14-24(29)31-22(25)13-17)30-16-23(28)26-20-8-10-27(11-9-20)15-19-6-4-3-5-7-19/h3-7,12-14,20H,8-11,15-16H2,1-2H3,(H,26,28)/p+1