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

Systemtic Name: 2-(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl)oxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]ethanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2-methyl-4-oxo-3-phenoxy-chromen-7-yl)oxy-acetamide CAS Name: 2-[(2-methyl-4-oxo-3-phenoxy-1-benzopyran-7-yl)oxy]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]acetamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-(4-keto-2-methyl-3-phenoxy-chromen-7-yl)oxy-acetamide Formula: C30H31N2O5+ MolecularWeight: 499.57754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C30H30N2O5/c1-21-30(37-24-10-6-3-7-11-24)29(34)26-13-12-25(18-27(26)36-21)35-20-28(33)31-23-14-16-32(17-15-23)19-22-8-4-2-5-9-22/h2-13,18,23H,14-17,19-20H2,1H3,(H,31,33)/p+1