(3R)-1-[2-[(3,4-dichlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[(3,4-dichlorophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-[(3,4-dichlorophenyl)methyl-methyl-amino]-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-[(3,4-dichlorophenyl)methyl-methylamino]-2-oxoethyl]-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-[(3,4-dichlorophenyl)methyl-methylamino]-2-oxoethyl]-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-[(3,4-dichlorobenzyl)-methyl-amino]-2-keto-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C22H26Cl2N3O2+ MolecularWeight: 435.36674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25Cl2N3O2/c1-26(13-16-9-10-19(23)20(24)12-16)21(28)15-27-11-5-6-17(14-27)22(29)25-18-7-3-2-4-8-18/h2-4,7-10,12,17H,5-6,11,13-15H2,1H3,(H,25,29)/p+1/t17-/m1/s1