(3R)-N-[2-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide

Systemtic Name: (3R)-N-[2-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Openeye Name: (3R)-N-[2-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide CAS Name: (3R)-N-[2-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide IUPAC Name: (3R)-N-[2-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Traditional Name: (3R)-N-[2-(4-methoxyphenyl)ethyl]-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2CC3=CC=CC=C3C[NH2+]2

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)[C@H]2CC3=CC=CC=C3C[NH2+]2

InChI

InChI=1S/C19H22N2O2/c1-23-17-8-6-14(7-9-17)10-11-20-19(22)18-12-15-4-2-3-5-16(15)13-21-18/h2-9,18,21H,10-13H2,1H3,(H,20,22)/p+1/t18-/m1/s1