(4-bromophenyl)methyl 4-methyl-3-(2-methylpropanoylamino)benzoate

Systemtic Name: (4-bromophenyl)methyl 4-methyl-3-(2-methylpropanoylamino)benzoate Openeye Name: (4-bromophenyl)methyl 4-methyl-3-(2-methylpropanoylamino)benzoate CAS Name: 4-methyl-3-[(2-methyl-1-oxopropyl)amino]benzoic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 4-methyl-3-(2-methylpropanoylamino)benzoate Traditional Name: 3-(isobutyrylamino)-4-methyl-benzoic acid (4-bromobenzyl) ester Formula: C19H20BrNO3 MolecularWeight: 390.271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)Br)NC(=O)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)Br)NC(=O)C(C)C

InChI

InChI=1S/C19H20BrNO3/c1-12(2)18(22)21-17-10-15(7-4-13(17)3)19(23)24-11-14-5-8-16(20)9-6-14/h4-10,12H,11H2,1-3H3,(H,21,22)