[1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [1-(4-bromophenyl)-1-oxidanylidene-propan-2-yl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-(4-bromophenyl)-1-methyl-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromophenyl)-1-oxopropan-2-yl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-(4-bromophenyl)-2-keto-1-methyl-ethyl] ester Formula: C16H13BrClNO3 MolecularWeight: 382.63632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC(=C(C=C2)Cl)N

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C16H13BrClNO3/c1-9(15(20)10-2-5-12(17)6-3-10)22-16(21)11-4-7-13(18)14(19)8-11/h2-9H,19H2,1H3