ethyl 3-bromanyl-4-[(phenylmethyl)amino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[(phenylmethyl)amino]benzoate Openeye Name: ethyl 4-(benzylamino)-3-bromo-benzoate CAS Name: 3-bromo-4-[(phenylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-3-bromobenzoate Traditional Name: 4-(benzylamino)-3-bromo-benzoic acid ethyl ester Formula: C16H16BrNO2 MolecularWeight: 334.20774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrNO2/c1-2-20-16(19)13-8-9-15(14(17)10-13)18-11-12-6-4-3-5-7-12/h3-10,18H,2,11H2,1H3