methyl 3-bromanyl-4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]benzoate

Systemtic Name: methyl 3-bromanyl-4-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]benzoate Openeye Name: methyl 4-[2-(benzylamino)-2-oxo-ethoxy]-3-bromo-benzoate CAS Name: 3-bromo-4-[2-oxo-2-[(phenylmethyl)amino]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(benzylamino)-2-oxoethoxy]-3-bromobenzoate Traditional Name: 4-[2-(benzylamino)-2-keto-ethoxy]-3-bromo-benzoic acid methyl ester Formula: C17H16BrNO4 MolecularWeight: 378.21724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO4/c1-22-17(21)13-7-8-15(14(18)9-13)23-11-16(20)19-10-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,19,20)