3-pyrimidin-2-yl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxylic acid

Systemtic Name: 3-pyrimidin-2-yl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxylic acid Openeye Name: 3-pyrimidin-2-yl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxylic acid CAS Name: 3-(2-pyrimidinyl)-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxylic acid IUPAC Name: 3-pyrimidin-2-yl-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxylic acid Traditional Name: 3-(2-pyrimidyl)-1,2,4,4a,5,6-hexahydropyrazino[1,2-a]quinoline-5-carboxylic acid Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(CN1C3=NC=CC=N3)C(CC4=CC=CC=C42)C(=O)O

Isomeric SMILES

C1CN2C(CN1C3=NC=CC=N3)C(CC4=CC=CC=C42)C(=O)O

InChI

InChI=1S/C17H18N4O2/c22-16(23)13-10-12-4-1-2-5-14(12)21-9-8-20(11-15(13)21)17-18-6-3-7-19-17/h1-7,13,15H,8-11H2,(H,22,23)