(3R)-2-pyrazin-2-ylcarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name: (3R)-2-pyrazin-2-ylcarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Openeye Name: (3R)-2-(pyrazine-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid CAS Name: (3R)-2-[oxo(2-pyrazinyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid IUPAC Name: (3R)-2-(pyrazine-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Traditional Name: (3R)-2-pyrazinoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid Formula: C15H13N3O3 MolecularWeight: 283.28202

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=NC=CN=C3)C(=O)O

Isomeric SMILES

C1[C@@H](N(CC2=CC=CC=C21)C(=O)C3=NC=CN=C3)C(=O)O

InChI

InChI=1S/C15H13N3O3/c19-14(12-8-16-5-6-17-12)18-9-11-4-2-1-3-10(11)7-13(18)15(20)21/h1-6,8,13H,7,9H2,(H,20,21)/t13-/m1/s1