[4-bromanyl-2-[[2-(3-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] methanesulfonate

Systemtic Name: [4-bromanyl-2-[[2-(3-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]phenyl] methanesulfonate Openeye Name: [4-bromo-2-[[2-(m-tolyl)-5-oxo-oxazol-4-ylidene]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-bromo-2-[[2-(3-methylphenyl)-5-oxo-4-oxazolylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[[2-(3-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-bromo-2-[[5-keto-2-(m-tolyl)-2-oxazolin-4-ylidene]methyl]phenyl] ester Formula: C18H14BrNO5S MolecularWeight: 436.27646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CC3=C(C=CC(=C3)Br)OS(=O)(=O)C)C(=O)O2

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CC3=C(C=CC(=C3)Br)OS(=O)(=O)C)C(=O)O2

InChI

InChI=1S/C18H14BrNO5S/c1-11-4-3-5-12(8-11)17-20-15(18(21)24-17)10-13-9-14(19)6-7-16(13)25-26(2,22)23/h3-10H,1-2H3