5-chloranyl-4-[(4,6-dimethylpyrimidin-2-yl)amino]-2-methoxy-benzoic acid

Systemtic Name: 5-chloranyl-4-[(4,6-dimethylpyrimidin-2-yl)amino]-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-[(4,6-dimethylpyrimidin-2-yl)amino]-2-methoxy-benzoic acid CAS Name: 5-chloro-4-[(4,6-dimethyl-2-pyrimidinyl)amino]-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-[(4,6-dimethylpyrimidin-2-yl)amino]-2-methoxybenzoic acid Traditional Name: 5-chloro-4-[(4,6-dimethylpyrimidin-2-yl)amino]-2-methoxy-benzoic acid Formula: C14H14ClN3O3 MolecularWeight: 307.73226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=C(C=C(C(=C2)OC)C(=O)O)Cl)C

InChI

InChI=1S/C14H14ClN3O3/c1-7-4-8(2)17-14(16-7)18-11-6-12(21-3)9(13(19)20)5-10(11)15/h4-6H,1-3H3,(H,19,20)(H,16,17,18)