methyl (2S)-2-[(7-bromanyl-1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]propanoate

Systemtic Name: methyl (2S)-2-[(7-bromanyl-1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]propanoate Openeye Name: methyl (2S)-2-[(7-bromo-2-hydroxy-1-methyl-4-oxo-quinoline-3-carbonyl)amino]propanoate CAS Name: (2S)-2-[[(7-bromo-2-hydroxy-1-methyl-4-oxo-3-quinolinyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(7-bromo-2-hydroxy-1-methyl-4-oxoquinoline-3-carbonyl)amino]propanoate Traditional Name: (2S)-2-[(7-bromo-2-hydroxy-4-keto-1-methyl-quinoline-3-carbonyl)amino]propionic acid methyl ester Formula: C15H15BrN2O5 MolecularWeight: 383.194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1=C(N(C2=C(C1=O)C=CC(=C2)Br)C)O

Isomeric SMILES

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

InChI

InChI=1S/C15H15BrN2O5/c1-7(15(22)23-3)17-13(20)11-12(19)9-5-4-8(16)6-10(9)18(2)14(11)21/h4-7,21H,1-3H3,(H,17,20)/t7-/m0/s1