(2R)-N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(5-chloranyl-2-methoxy-phenyl)-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-(4-benzylpyridin-1-ium-1-yl)-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: (2R)-N-(5-chloro-2-methoxyphenyl)-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]propanamide IUPAC Name: (2R)-2-(4-benzylpyridin-1-ium-1-yl)-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: (2R)-2-(4-benzylpyridin-1-ium-1-yl)-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C22H22ClN2O2+ MolecularWeight: 381.87528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)Cl)OC)[N+]2=CC=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H21ClN2O2/c1-16(22(26)24-20-15-19(23)8-9-21(20)27-2)25-12-10-18(11-13-25)14-17-6-4-3-5-7-17/h3-13,15-16H,14H2,1-2H3/p+1/t16-/m1/s1