2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-propan-2-yl-pyrimidine-4-carboxylic acid

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-propan-2-yl-pyrimidine-4-carboxylic acid Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-isopropyl-pyrimidine-4-carboxylic acid CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-propan-2-yl-4-pyrimidinecarboxylic acid IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-propan-2-ylpyrimidine-4-carboxylic acid Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-isopropyl-pyrimidine-4-carboxylic acid Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C(=O)O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C(=O)O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H19N3O2/c1-11(2)14-9-15(16(21)22)19-17(18-14)20-8-7-12-5-3-4-6-13(12)10-20/h3-6,9,11H,7-8,10H2,1-2H3,(H,21,22)