4-[(2-chloranyl-4-methoxy-phenyl)methoxy]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylate

Systemtic Name: 4-[(2-chloranyl-4-methoxy-phenyl)methoxy]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylate Openeye Name: 4-[(2-chloro-4-methoxy-phenyl)methoxy]-2-(2-methylindolin-1-yl)pyrimidine-5-carboxylate CAS Name: 4-[(2-chloro-4-methoxyphenyl)methoxy]-2-(2-methyl-2,3-dihydroindol-1-yl)-5-pyrimidinecarboxylate IUPAC Name: 4-[(2-chloro-4-methoxyphenyl)methoxy]-2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-(2-chloro-4-methoxy-benzyl)oxy-2-(2-methylindolin-1-yl)pyrimidine-5-carboxylate Formula: C22H19ClN3O4- MolecularWeight: 424.85696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C(=N3)OCC4=C(C=C(C=C4)OC)Cl)C(=O)[O-]

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC=C(C(=N3)OCC4=C(C=C(C=C4)OC)Cl)C(=O)[O-]

InChI

InChI=1S/C22H20ClN3O4/c1-13-9-14-5-3-4-6-19(14)26(13)22-24-11-17(21(27)28)20(25-22)30-12-15-7-8-16(29-2)10-18(15)23/h3-8,10-11,13H,9,12H2,1-2H3,(H,27,28)/p-1