phenyl (2S,3S)-6-(3-bromanylbut-3-enyl)-2-[(4-methoxyphenyl)methyl]-3-oxidanyl-4-oxidanylidene-2,3-dihydropyridine-1-carboxylate

Systemtic Name: phenyl (2S,3S)-6-(3-bromanylbut-3-enyl)-2-[(4-methoxyphenyl)methyl]-3-oxidanyl-4-oxidanylidene-2,3-dihydropyridine-1-carboxylate Openeye Name: phenyl (2S,3S)-6-(3-bromobut-3-enyl)-3-hydroxy-2-[(4-methoxyphenyl)methyl]-4-oxo-2,3-dihydropyridine-1-carboxylate CAS Name: (2S,3S)-6-(3-bromobut-3-enyl)-3-hydroxy-2-[(4-methoxyphenyl)methyl]-4-oxo-2,3-dihydropyridine-1-carboxylic acid phenyl ester IUPAC Name: phenyl (2S,3S)-6-(3-bromobut-3-enyl)-3-hydroxy-2-[(4-methoxyphenyl)methyl]-4-oxo-2,3-dihydropyridine-1-carboxylate Traditional Name: (2S,3S)-6-(3-bromobut-3-enyl)-3-hydroxy-4-keto-2-p-anisyl-2,3-dihydropyridine-1-carboxylic acid phenyl ester Formula: C24H24BrNO5 MolecularWeight: 486.35506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2C(C(=O)C=C(N2C(=O)OC3=CC=CC=C3)CCC(=C)Br)O

Isomeric SMILES

COC1=CC=C(C=C1)C[C@H]2[C@@H](C(=O)C=C(N2C(=O)OC3=CC=CC=C3)CCC(=C)Br)O

InChI

InChI=1S/C24H24BrNO5/c1-16(25)8-11-18-15-22(27)23(28)21(14-17-9-12-19(30-2)13-10-17)26(18)24(29)31-20-6-4-3-5-7-20/h3-7,9-10,12-13,15,21,23,28H,1,8,11,14H2,2H3/t21-,23-/m0/s1