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2-(4,6-dimethoxypyrimidin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

2-(4,6-dimethoxypyrimidin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid

Systemtic Name:2-(4,6-dimethoxypyrimidin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Openeye Name:2-(4,6-dimethoxypyrimidin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CAS Name:2-(4,6-dimethoxy-2-pyrimidinyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
IUPAC Name:2-(4,6-dimethoxypyrimidin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Traditional Name:2-(4,6-dimethoxypyrimidin-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Formula: C16H17N3O4
MolecularWeight: 315.32388
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)N2CC3=CC=CC=C3CC2C(=O)O)OC


Isomeric SMILES

COC1=CC(=NC(=N1)N2CC3=CC=CC=C3CC2C(=O)O)OC


InChI

InChI=1S/C16H17N3O4/c1-22-13-8-14(23-2)18-16(17-13)19-9-11-6-4-3-5-10(11)7-12(19)15(20)21/h3-6,8,12H,7,9H2,1-2H3,(H,20,21)


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