N-[1-[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide

Systemtic Name: N-[1-[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide Openeye Name: N-[1-[2-(2,5-dimethoxyanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide CAS Name: N-[1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-2-methylbenzamide IUPAC Name: N-[1-[2-(2,5-dimethoxyanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-2-methylbenzamide Traditional Name: N-[1-[2-(2,5-dimethoxyanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]-2-methyl-benzamide Formula: C23H30N3O4+ MolecularWeight: 412.502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C23H29N3O4/c1-16-6-4-5-7-19(16)23(28)24-17-10-12-26(13-11-17)15-22(27)25-20-14-18(29-2)8-9-21(20)30-3/h4-9,14,17H,10-13,15H2,1-3H3,(H,24,28)(H,25,27)/p+1