3-(8-bromanyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)propanoate

Systemtic Name: 3-(8-bromanyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)propanoate Openeye Name: 3-(8-bromo-2-methyl-4-oxo-1H-quinolin-3-yl)propanoate CAS Name: 3-(8-bromo-2-methyl-4-oxo-1H-quinolin-3-yl)propanoate IUPAC Name: 3-(8-bromo-2-methyl-4-oxo-1H-quinolin-3-yl)propanoate Traditional Name: 3-(8-bromo-4-keto-2-methyl-1H-quinolin-3-yl)propionate Formula: C13H11BrNO3- MolecularWeight: 309.13534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C(=CC=C2)Br)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C(=CC=C2)Br)CCC(=O)[O-]

InChI

InChI=1S/C13H12BrNO3/c1-7-8(5-6-11(16)17)13(18)9-3-2-4-10(14)12(9)15-7/h2-4H,5-6H2,1H3,(H,15,18)(H,16,17)/p-1