3-acetamido-5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-1H-indole-4-carboxylic acid

Systemtic Name: 3-acetamido-5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-1H-indole-4-carboxylic acid Openeye Name: 3-acetamido-5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-1H-indole-4-carboxylic acid CAS Name: 3-acetamido-5-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-2-methyl-1H-indole-4-carboxylic acid IUPAC Name: 3-acetamido-5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-1H-indole-4-carboxylic acid Traditional Name: 3-acetamido-5-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methyl-1H-indole-4-carboxylic acid Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2C(=O)O)OC3=NC(=CC(=N3)OC)OC)NC(=O)C

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2C(=O)O)OC3=NC(=CC(=N3)OC)OC)NC(=O)C

InChI

InChI=1S/C18H18N4O6/c1-8-16(20-9(2)23)14-10(19-8)5-6-11(15(14)17(24)25)28-18-21-12(26-3)7-13(22-18)27-4/h5-7,19H,1-4H3,(H,20,23)(H,24,25)