methyl (3S,6S)-6-[2-(3-bromanyl-5-methoxycarbonyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-3-oxidanyl-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: methyl (3S,6S)-6-[2-(3-bromanyl-5-methoxycarbonyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl]-3-oxidanyl-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: methyl (3S,6S)-6-[2-(3-bromo-5-methoxycarbonyl-1H-pyrrol-2-yl)-2-oxo-ethyl]-3-hydroxy-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: (3S,6S)-6-[2-(3-bromo-5-methoxycarbonyl-1H-pyrrol-2-yl)-2-oxoethyl]-3-hydroxy-3,6-dihydro-2H-pyridine-1-carboxylic acid methyl ester IUPAC Name: methyl (3S,6S)-6-[2-(3-bromo-5-methoxycarbonyl-1H-pyrrol-2-yl)-2-oxoethyl]-3-hydroxy-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: (3S,6S)-6-[2-(3-bromo-5-carbomethoxy-1H-pyrrol-2-yl)-2-keto-ethyl]-3-hydroxy-3,6-dihydro-2H-pyridine-1-carboxylic acid methyl ester Formula: C15H17BrN2O6 MolecularWeight: 401.20928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N1)C(=O)CC2C=CC(CN2C(=O)OC)O)Br

Isomeric SMILES

COC(=O)C1=CC(=C(N1)C(=O)C[C@H]2C=C[C@@H](CN2C(=O)OC)O)Br

InChI

InChI=1S/C15H17BrN2O6/c1-23-14(21)11-6-10(16)13(17-11)12(20)5-8-3-4-9(19)7-18(8)15(22)24-2/h3-4,6,8-9,17,19H,5,7H2,1-2H3/t8-,9+/m1/s1