[1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybutanoate

Systemtic Name: [1-[(4-bromophenyl)amino]-1-oxidanylidene-propan-2-yl] 4-phenoxybutanoate Openeye Name: [2-(4-bromoanilino)-1-methyl-2-oxo-ethyl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [1-(4-bromoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromoanilino)-1-oxopropan-2-yl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [2-(4-bromoanilino)-2-keto-1-methyl-ethyl] ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)Br)OC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)Br)OC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C19H20BrNO4/c1-14(19(23)21-16-11-9-15(20)10-12-16)25-18(22)8-5-13-24-17-6-3-2-4-7-17/h2-4,6-7,9-12,14H,5,8,13H2,1H3,(H,21,23)