2-(4-methoxy-6-methyl-pyrimidin-2-yl)-4,4-dimethyl-1,3-dihydroisoquinoline-3-carboxylic acid

Systemtic Name: 2-(4-methoxy-6-methyl-pyrimidin-2-yl)-4,4-dimethyl-1,3-dihydroisoquinoline-3-carboxylic acid Openeye Name: 2-(4-methoxy-6-methyl-pyrimidin-2-yl)-4,4-dimethyl-1,3-dihydroisoquinoline-3-carboxylic acid CAS Name: 2-(4-methoxy-6-methyl-2-pyrimidinyl)-4,4-dimethyl-1,3-dihydroisoquinoline-3-carboxylic acid IUPAC Name: 2-(4-methoxy-6-methylpyrimidin-2-yl)-4,4-dimethyl-1,3-dihydroisoquinoline-3-carboxylic acid Traditional Name: 2-(4-methoxy-6-methyl-pyrimidin-2-yl)-4,4-dimethyl-1,3-dihydroisoquinoline-3-carboxylic acid Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CC3=CC=CC=C3C(C2C(=O)O)(C)C)OC

Isomeric SMILES

CC1=CC(=NC(=N1)N2CC3=CC=CC=C3C(C2C(=O)O)(C)C)OC

InChI

InChI=1S/C18H21N3O3/c1-11-9-14(24-4)20-17(19-11)21-10-12-7-5-6-8-13(12)18(2,3)15(21)16(22)23/h5-9,15H,10H2,1-4H3,(H,22,23)