diethyl (4S)-4-(5-bromanylfuran-2-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl (4S)-4-(5-bromanylfuran-2-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl (4S)-4-(5-bromo-2-furyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-4-(5-bromo-2-furanyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl (4S)-4-(5-bromofuran-2-yl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-4-(5-bromo-2-furyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C17H20BrNO5 MolecularWeight: 398.2484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(N=C1C)C)C(=O)OCC)C2=CC=C(O2)Br

Isomeric SMILES

CCOC(=O)C1[C@@H](C(=C(N=C1C)C)C(=O)OCC)C2=CC=C(O2)Br

InChI

InChI=1S/C17H20BrNO5/c1-5-22-16(20)13-9(3)19-10(4)14(17(21)23-6-2)15(13)11-7-8-12(18)24-11/h7-8,13,15H,5-6H2,1-4H3/t13?,15-/m0/s1