methyl (5S)-5-[(S)-bromanyl(phenyl)methyl]-4-methoxy-5-oxidanyl-2-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: methyl (5S)-5-[(S)-bromanyl(phenyl)methyl]-4-methoxy-5-oxidanyl-2-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: methyl (5S)-5-[(S)-bromo(phenyl)methyl]-5-hydroxy-4-methoxy-2-oxo-1H-pyrrole-3-carboxylate CAS Name: (5S)-5-[(S)-bromo(phenyl)methyl]-5-hydroxy-4-methoxy-2-oxo-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl (5S)-5-[(S)-bromo(phenyl)methyl]-5-hydroxy-4-methoxy-2-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5S)-5-[(S)-bromo(phenyl)methyl]-5-hydroxy-2-keto-4-methoxy-3-pyrroline-3-carboxylic acid methyl ester Formula: C14H14BrNO5 MolecularWeight: 356.16866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=O)NC1(C(C2=CC=CC=C2)Br)O)C(=O)OC

Isomeric SMILES

COC1=C(C(=O)N[C@]1([C@H](C2=CC=CC=C2)Br)O)C(=O)OC

InChI

InChI=1S/C14H14BrNO5/c1-20-11-9(13(18)21-2)12(17)16-14(11,19)10(15)8-6-4-3-5-7-8/h3-7,10,19H,1-2H3,(H,16,17)/t10-,14+/m0/s1