(3S)-2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide

Systemtic Name: (3S)-2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Openeye Name: (3S)-2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide CAS Name: (3S)-2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide IUPAC Name: (3S)-2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Traditional Name: (3S)-2-ethyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC2=CC=CC=C2CC1C(=O)N

Isomeric SMILES

CC[NH+]1CC2=CC=CC=C2C[C@H]1C(=O)N

InChI

InChI=1S/C12H16N2O/c1-2-14-8-10-6-4-3-5-9(10)7-11(14)12(13)15/h3-6,11H,2,7-8H2,1H3,(H2,13,15)/p+1/t11-/m0/s1