(3R)-N-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide

Systemtic Name: (3R)-N-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Openeye Name: (3R)-N-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide CAS Name: (3R)-N-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide IUPAC Name: (3R)-N-pentyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Traditional Name: (3R)-N-amyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1CC2=CC=CC=C2C[NH2+]1

Isomeric SMILES

CCCCCNC(=O)[C@H]1CC2=CC=CC=C2C[NH2+]1

InChI

InChI=1S/C15H22N2O/c1-2-3-6-9-16-15(18)14-10-12-7-4-5-8-13(12)11-17-14/h4-5,7-8,14,17H,2-3,6,9-11H2,1H3,(H,16,18)/p+1/t14-/m1/s1