[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 4-azanylbenzoate

Systemtic Name: [1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 4-azanylbenzoate Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]propyl 4-aminobenzoate CAS Name: 4-aminobenzoic acid [1-(4-bromo-2-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-bromo-2-fluoroanilino)-1-oxobutan-2-yl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]propyl ester Formula: C17H16BrFN2O3 MolecularWeight: 395.222943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C17H16BrFN2O3/c1-2-15(24-17(23)10-3-6-12(20)7-4-10)16(22)21-14-8-5-11(18)9-13(14)19/h3-9,15H,2,20H2,1H3,(H,21,22)