3-chloranyl-N-[2-[[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-chloro-N-[2-[[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]amino]-2-oxo-ethyl]benzamide CAS Name: 3-chloro-N-[2-[[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]amino]-2-oxoethyl]benzamide IUPAC Name: 3-chloro-N-[2-[[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]amino]-2-oxoethyl]benzamide Traditional Name: 3-chloro-N-[2-keto-2-[[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]amino]ethyl]benzamide Formula: C23H29ClN3O3+ MolecularWeight: 430.94766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CNC(=O)C2=CC(=CC=C2)Cl)[NH+]3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)CNC(=O)C2=CC(=CC=C2)Cl)[NH+]3CCCCC3

InChI

InChI=1S/C23H28ClN3O3/c1-30-20-10-8-17(9-11-20)21(27-12-3-2-4-13-27)15-25-22(28)16-26-23(29)18-6-5-7-19(24)14-18/h5-11,14,21H,2-4,12-13,15-16H2,1H3,(H,25,28)(H,26,29)/p+1/t21-/m0/s1