methyl 5-bromanyl-2-[(phenylmethyl)amino]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(phenylmethyl)amino]benzoate Openeye Name: methyl 2-(benzylamino)-5-bromo-benzoate CAS Name: 5-bromo-2-[(phenylmethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-(benzylamino)-5-bromobenzoate Traditional Name: 2-(benzylamino)-5-bromo-benzoic acid methyl ester Formula: C15H14BrNO2 MolecularWeight: 320.18116

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)NCC2=CC=CC=C2

InChI

InChI=1S/C15H14BrNO2/c1-19-15(18)13-9-12(16)7-8-14(13)17-10-11-5-3-2-4-6-11/h2-9,17H,10H2,1H3