ditert-butyl 4-(4-chloranyl-2-ethyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: ditert-butyl 4-(4-chloranyl-2-ethyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: ditert-butyl 4-(4-chloro-2-ethyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(4-chloro-2-ethyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 4-(4-chloro-2-ethyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(4-chloro-2-ethyl-1H-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid ditert-butyl ester Formula: C22H32ClN3O4 MolecularWeight: 437.96018

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C2C(=C(NC(=C2C(=O)OC(C)(C)C)C)C)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CCC1=NC(=C(N1)C2C(=C(NC(=C2C(=O)OC(C)(C)C)C)C)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C22H32ClN3O4/c1-10-13-25-17(18(23)26-13)16-14(19(27)29-21(4,5)6)11(2)24-12(3)15(16)20(28)30-22(7,8)9/h16,24H,10H2,1-9H3,(H,25,26)