(4-methoxyphenyl)methyl (4S)-4-(6-bromanyl-1,3-benzodioxol-5-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (4S)-4-(6-bromanyl-1,3-benzodioxol-5-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: (4-methoxyphenyl)methyl (4S)-4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate CAS Name: (4S)-4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (4S)-4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: (4S)-4-(6-bromo-1,3-benzodioxol-5-yl)-2-keto-6-methyl-3,4-dihydro-1H-pyridine-5-carboxylic acid p-anisyl ester Formula: C22H20BrNO6 MolecularWeight: 474.3013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1)C2=CC3=C(C=C2Br)OCO3)C(=O)OCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C([C@H](CC(=O)N1)C2=CC3=C(C=C2Br)OCO3)C(=O)OCC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20BrNO6/c1-12-21(22(26)28-10-13-3-5-14(27-2)6-4-13)16(8-20(25)24-12)15-7-18-19(9-17(15)23)30-11-29-18/h3-7,9,16H,8,10-11H2,1-2H3,(H,24,25)/t16-/m1/s1