(2R)-2-isoquinolin-2-ium-2-yl-N-(phenylmethyl)propanamide

Systemtic Name: (2R)-2-isoquinolin-2-ium-2-yl-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-2-isoquinolin-2-ium-2-yl-propanamide CAS Name: (2R)-2-(2-isoquinolin-2-iumyl)-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-2-isoquinolin-2-ium-2-ylpropanamide Traditional Name: (2R)-N-benzyl-2-isoquinolin-2-ium-2-yl-propionamide Formula: C19H19N2O+ MolecularWeight: 291.36696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)[N+]2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)[N+]2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H18N2O/c1-15(19(22)20-13-16-7-3-2-4-8-16)21-12-11-17-9-5-6-10-18(17)14-21/h2-12,14-15H,13H2,1H3/p+1/t15-/m1/s1