(2R)-N-methyl-N-(phenylmethyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide

Systemtic Name: (2R)-N-methyl-N-(phenylmethyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide Openeye Name: (2R)-N-benzyl-N-methyl-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide CAS Name: (2R)-N-methyl-N-(phenylmethyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide IUPAC Name: (2R)-N-benzyl-N-methyl-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propanamide Traditional Name: (2R)-N-benzyl-N-methyl-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)propionamide Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=CC=C1)[N+]2=CC3=C(CCCC3)C=C2

Isomeric SMILES

C[C@H](C(=O)N(C)CC1=CC=CC=C1)[N+]2=CC3=C(CCCC3)C=C2

InChI

InChI=1S/C20H25N2O/c1-16(20(23)21(2)14-17-8-4-3-5-9-17)22-13-12-18-10-6-7-11-19(18)15-22/h3-5,8-9,12-13,15-16H,6-7,10-11,14H2,1-2H3/q+1/t16-/m1/s1