methyl 5-bromanyl-2-(pentylamino)benzoate

Systemtic Name: methyl 5-bromanyl-2-(pentylamino)benzoate Openeye Name: methyl 5-bromo-2-(pentylamino)benzoate CAS Name: 5-bromo-2-(pentylamino)benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-(pentylamino)benzoate Traditional Name: 2-(amylamino)-5-bromo-benzoic acid methyl ester Formula: C13H18BrNO2 MolecularWeight: 300.19152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=C(C=C1)Br)C(=O)OC

Isomeric SMILES

CCCCCNC1=C(C=C(C=C1)Br)C(=O)OC

InChI

InChI=1S/C13H18BrNO2/c1-3-4-5-8-15-12-7-6-10(14)9-11(12)13(16)17-2/h6-7,9,15H,3-5,8H2,1-2H3