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

Systemtic Name: (3R)-N-pyrimidin-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Openeye Name: (3R)-N-pyrimidin-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide CAS Name: (3R)-N-(2-pyrimidinyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide IUPAC Name: (3R)-N-pyrimidin-2-yl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Traditional Name: (3R)-N-(2-pyrimidyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxamide Formula: C14H15N4O+ MolecularWeight: 255.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH2+]CC2=CC=CC=C21)C(=O)NC3=NC=CC=N3

Isomeric SMILES

C1[C@@H]([NH2+]CC2=CC=CC=C21)C(=O)NC3=NC=CC=N3

InChI

InChI=1S/C14H14N4O/c19-13(18-14-15-6-3-7-16-14)12-8-10-4-1-2-5-11(10)9-17-12/h1-7,12,17H,8-9H2,(H,15,16,18,19)/p+1/t12-/m1/s1