methyl (Z)-3-(3-bromanylquinolin-1-ium-1-yl)-4-methoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: methyl (Z)-3-(3-bromanylquinolin-1-ium-1-yl)-4-methoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: methyl (Z)-3-(3-bromoquinolin-1-ium-1-yl)-4-hydroxy-4-methoxy-2-oxo-but-3-enoate CAS Name: (Z)-3-(3-bromo-1-quinolin-1-iumyl)-4-hydroxy-4-methoxy-2-oxo-3-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3-bromoquinolin-1-ium-1-yl)-4-hydroxy-4-methoxy-2-oxobut-3-enoate Traditional Name: (Z)-3-(3-bromoquinolin-1-ium-1-yl)-4-hydroxy-2-keto-4-methoxy-but-3-enoic acid methyl ester Formula: C15H13BrNO5+ MolecularWeight: 367.17142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)C(=O)OC)[N+]1=CC(=CC2=CC=CC=C21)Br)O

Isomeric SMILES

CO/C(=C(/C(=O)C(=O)OC)\[N+]1=CC(=CC2=CC=CC=C21)Br)/O

InChI

InChI=1S/C15H12BrNO5/c1-21-14(19)12(13(18)15(20)22-2)17-8-10(16)7-9-5-3-4-6-11(9)17/h3-8H,1-2H3/p+1