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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O/c1-3-13(4-2)17-15(18)14-9-11-7-5-6-8-12(11)10-16-14/h5-8,13-14,16H,3-4,9-10H2,1-2H3,(H,17,18)/p+1/t14-/m1/s1