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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O/c1-11(2)7-8-16-15(18)14-9-12-5-3-4-6-13(12)10-17-14/h3-6,11,14,17H,7-10H2,1-2H3,(H,16,18)/p+1/t14-/m1/s1