[4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3,6-bis(chloranyl)-2-methoxy-benzoate

Systemtic Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3,6-bis(chloranyl)-2-methoxy-benzoate Openeye Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3,6-dichloro-2-methoxy-benzoate CAS Name: 3,6-dichloro-2-methoxybenzoic acid [4-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3,6-dichloro-2-methoxybenzoate Traditional Name: 3,6-dichloro-2-methoxy-benzoic acid [4-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C19H15Cl2N3O3 MolecularWeight: 404.2467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC=C(C=C2)OC(=O)C3=C(C=CC(=C3OC)Cl)Cl

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC=C(C=C2)OC(=O)C3=C(C=CC(=C3OC)Cl)Cl

InChI

InChI=1S/C19H15Cl2N3O3/c1-11-9-16(23-10-22-11)24-12-3-5-13(6-4-12)27-19(25)17-14(20)7-8-15(21)18(17)26-2/h3-10H,1-2H3,(H,22,23,24)