(3,5-dimethylphenyl)methyl 2-[(4-bromophenyl)carbonylamino]ethanoate

Systemtic Name: (3,5-dimethylphenyl)methyl 2-[(4-bromophenyl)carbonylamino]ethanoate Openeye Name: (3,5-dimethylphenyl)methyl 2-[(4-bromobenzoyl)amino]acetate CAS Name: 2-[[(4-bromophenyl)-oxomethyl]amino]acetic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl 2-[(4-bromobenzoyl)amino]acetate Traditional Name: 2-[(4-bromobenzoyl)amino]acetic acid (3,5-dimethylbenzyl) ester Formula: C18H18BrNO3 MolecularWeight: 376.24442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC(=O)CNC(=O)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)COC(=O)CNC(=O)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C18H18BrNO3/c1-12-7-13(2)9-14(8-12)11-23-17(21)10-20-18(22)15-3-5-16(19)6-4-15/h3-9H,10-11H2,1-2H3,(H,20,22)