methyl (2S,4R)-1-[[7-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-[[7-bromanyl-2,3-bis(oxidanylidene)indol-1-yl]methyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S,4R)-1-[(7-bromo-2,3-dioxo-indolin-1-yl)methyl]-4-hydroxy-pyrrolidin-1-ium-2-carboxylate CAS Name: (2S,4R)-1-[(7-bromo-2,3-dioxo-1-indolyl)methyl]-4-hydroxy-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-1-[(7-bromo-2,3-dioxoindol-1-yl)methyl]-4-hydroxypyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,4R)-1-[(7-bromo-2,3-diketo-indolin-1-yl)methyl]-4-hydroxy-pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C15H16BrN2O5+ MolecularWeight: 384.20194

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(C[NH+]1CN2C3=C(C=CC=C3Br)C(=O)C2=O)O

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](C[NH+]1CN2C3=C(C=CC=C3Br)C(=O)C2=O)O

InChI

InChI=1S/C15H15BrN2O5/c1-23-15(22)11-5-8(19)6-17(11)7-18-12-9(13(20)14(18)21)3-2-4-10(12)16/h2-4,8,11,19H,5-7H2,1H3/p+1/t8-,11+/m1/s1