methyl 3-bromanyl-5-methyl-2-(propylamino)benzoate

Systemtic Name: methyl 3-bromanyl-5-methyl-2-(propylamino)benzoate Openeye Name: methyl 3-bromo-5-methyl-2-(propylamino)benzoate CAS Name: 3-bromo-5-methyl-2-(propylamino)benzoic acid methyl ester IUPAC Name: methyl 3-bromo-5-methyl-2-(propylamino)benzoate Traditional Name: 3-bromo-5-methyl-2-(propylamino)benzoic acid methyl ester Formula: C12H16BrNO2 MolecularWeight: 286.16494

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1C(=O)OC)C)Br

Isomeric SMILES

CCCNC1=C(C=C(C=C1C(=O)OC)C)Br

InChI

InChI=1S/C12H16BrNO2/c1-4-5-14-11-9(12(15)16-3)6-8(2)7-10(11)13/h6-7,14H,4-5H2,1-3H3