[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate

Systemtic Name: [1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Openeye Name: [2-(4-bromo-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate CAS Name: 8-(1,3-benzoxazol-2-yl)-1-naphthalenecarboxylic acid [1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Traditional Name: 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylic acid [2-(4-bromo-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C27H18BrFN2O4 MolecularWeight: 533.345223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C27H18BrFN2O4/c1-15(25(32)30-21-13-12-17(28)14-20(21)29)34-27(33)19-9-5-7-16-6-4-8-18(24(16)19)26-31-22-10-2-3-11-23(22)35-26/h2-15H,1H3,(H,30,32)