methyl 3-bromanyl-5-chloranyl-2-(pentylamino)benzoate

Systemtic Name: methyl 3-bromanyl-5-chloranyl-2-(pentylamino)benzoate Openeye Name: methyl 3-bromo-5-chloro-2-(pentylamino)benzoate CAS Name: 3-bromo-5-chloro-2-(pentylamino)benzoic acid methyl ester IUPAC Name: methyl 3-bromo-5-chloro-2-(pentylamino)benzoate Traditional Name: 2-(amylamino)-3-bromo-5-chloro-benzoic acid methyl ester Formula: C13H17BrClNO2 MolecularWeight: 334.63658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1C(=O)OC)Cl)Br

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1C(=O)OC)Cl)Br

InChI

InChI=1S/C13H17BrClNO2/c1-3-4-5-6-16-12-10(13(17)18-2)7-9(15)8-11(12)14/h7-8,16H,3-6H2,1-2H3