methyl 3-[(4-bromanyl-3-methyl-phenyl)amino]butanoate

Systemtic Name: methyl 3-[(4-bromanyl-3-methyl-phenyl)amino]butanoate Openeye Name: methyl 3-(4-bromo-3-methyl-anilino)butanoate CAS Name: 3-(4-bromo-3-methylanilino)butanoic acid methyl ester IUPAC Name: methyl 3-(4-bromo-3-methylanilino)butanoate Traditional Name: 3-(4-bromo-3-methyl-anilino)butyric acid methyl ester Formula: C12H16BrNO2 MolecularWeight: 286.16494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(C)CC(=O)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(C)CC(=O)OC)Br

InChI

InChI=1S/C12H16BrNO2/c1-8-6-10(4-5-11(8)13)14-9(2)7-12(15)16-3/h4-6,9,14H,7H2,1-3H3