N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-[(1R)-1-cyano-1-cyclopropylethyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-[(1R)-1-cyano-1-cyclopropyl-ethyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C17H22N3O+ MolecularWeight: 284.37608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H21N3O/c1-17(12-18,15-6-7-15)19-16(21)11-20-9-8-13-4-2-3-5-14(13)10-20/h2-5,15H,6-11H2,1H3,(H,19,21)/p+1/t17-/m0/s1