(2R)-N-(5-chloranyl-2-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-propanamide

Systemtic Name: (2R)-N-(5-chloranyl-2-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-propanamide Openeye Name: (2R)-N-(5-chloro-2-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-propanamide CAS Name: (2R)-N-(5-chloro-2-methoxyphenyl)-2-(2-isoquinolin-2-iumyl)propanamide IUPAC Name: (2R)-N-(5-chloro-2-methoxyphenyl)-2-isoquinolin-2-ium-2-ylpropanamide Traditional Name: (2R)-N-(5-chloro-2-methoxy-phenyl)-2-isoquinolin-2-ium-2-yl-propionamide Formula: C19H18ClN2O2+ MolecularWeight: 341.81142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)Cl)OC)[N+]2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)Cl)OC)[N+]2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H17ClN2O2/c1-13(22-10-9-14-5-3-4-6-15(14)12-22)19(23)21-17-11-16(20)7-8-18(17)24-2/h3-13H,1-2H3/p+1/t13-/m1/s1