methyl (4R)-4-(4-bromophenyl)-4-[4-(dimethylamino)-2-methoxy-phenyl]-2-oxidanylidene-butanoate

Systemtic Name: methyl (4R)-4-(4-bromophenyl)-4-[4-(dimethylamino)-2-methoxy-phenyl]-2-oxidanylidene-butanoate Openeye Name: methyl (4R)-4-(4-bromophenyl)-4-[4-(dimethylamino)-2-methoxy-phenyl]-2-oxo-butanoate CAS Name: (4R)-4-(4-bromophenyl)-4-[4-(dimethylamino)-2-methoxyphenyl]-2-oxobutanoic acid methyl ester IUPAC Name: methyl (4R)-4-(4-bromophenyl)-4-[4-(dimethylamino)-2-methoxyphenyl]-2-oxobutanoate Traditional Name: (4R)-4-(4-bromophenyl)-4-[4-(dimethylamino)-2-methoxy-phenyl]-2-keto-butyric acid methyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)C(CC(=O)C(=O)OC)C2=CC=C(C=C2)Br)OC

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)[C@H](CC(=O)C(=O)OC)C2=CC=C(C=C2)Br)OC

InChI

InChI=1S/C20H22BrNO4/c1-22(2)15-9-10-16(19(11-15)25-3)17(12-18(23)20(24)26-4)13-5-7-14(21)8-6-13/h5-11,17H,12H2,1-4H3/t17-/m1/s1