2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetamide CAS Name: 2-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(7-hydroxy-2-keto-4,8-dimethyl-chromen-3-yl)acetamide Formula: C25H29N2O4+ MolecularWeight: 421.50876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

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