(3R)-1-[2-[(3-chlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[(3-chlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-[(3-chlorophenyl)methyl-methyl-amino]-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-[(3-chlorophenyl)methyl-methylamino]-2-oxoethyl]-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-[(3-chlorophenyl)methyl-methylamino]-2-oxoethyl]-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-[(3-chlorobenzyl)-methyl-amino]-2-keto-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C22H27ClN3O2+ MolecularWeight: 400.92168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)Cl)C(=O)C[NH+]2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC(=CC=C1)Cl)C(=O)C[NH+]2CCC[C@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26ClN3O2/c1-25(14-17-7-5-9-19(23)13-17)21(27)16-26-12-6-8-18(15-26)22(28)24-20-10-3-2-4-11-20/h2-5,7,9-11,13,18H,6,8,12,14-16H2,1H3,(H,24,28)/p+1/t18-/m1/s1