dipropan-2-yl (4S)-4-[5-(3-bromophenyl)furan-2-yl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dipropan-2-yl (4S)-4-[5-(3-bromophenyl)furan-2-yl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diisopropyl (4S)-4-[5-(3-bromophenyl)-2-furyl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-4-[5-(3-bromophenyl)-2-furanyl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl (4S)-4-[5-(3-bromophenyl)furan-2-yl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-4-[5-(3-bromophenyl)-2-furyl]-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid diisopropyl ester Formula: C25H28BrNO5 MolecularWeight: 502.39752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC(C)C)C2=CC=C(O2)C3=CC(=CC=C3)Br)C(=O)OC(C)C)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OC(C)C)C2=CC=C(O2)C3=CC(=CC=C3)Br)C(=O)OC(C)C)C

InChI

InChI=1S/C25H28BrNO5/c1-13(2)30-24(28)21-15(5)27-16(6)22(25(29)31-14(3)4)23(21)20-11-10-19(32-20)17-8-7-9-18(26)12-17/h7-14,21,23H,1-6H3/t21?,23-/m0/s1