O3-(2-methoxyethyl) O5-propan-2-yl (4S)-4-(5-bromanyl-2-methoxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-methoxyethyl) O5-propan-2-yl (4S)-4-(5-bromanyl-2-methoxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(2-methoxyethyl) (4S)-4-(5-bromo-2-methoxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-4-(5-bromo-2-methoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-methoxyethyl) ester O5-propan-2-yl ester IUPAC Name: 3-O-(2-methoxyethyl) 5-O-propan-2-yl (4S)-4-(5-bromo-2-methoxyphenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-4-(5-bromo-2-methoxy-phenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-(2-methoxyethyl) ester Formula: C22H28BrNO6 MolecularWeight: 482.36482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OCCOC)C2=C(C=CC(=C2)Br)OC)C(=O)OC(C)C)C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OCCOC)C2=C(C=CC(=C2)Br)OC)C(=O)OC(C)C)C

InChI

InChI=1S/C22H28BrNO6/c1-12(2)30-22(26)19-14(4)24-13(3)18(21(25)29-10-9-27-5)20(19)16-11-15(23)7-8-17(16)28-6/h7-8,11-12,18,20H,9-10H2,1-6H3/t18?,20-/m1/s1