[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate CAS Name: 2-[(3-bromophenyl)methoxy]benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(3-bromophenyl)methoxy]benzoate Traditional Name: 2-(3-bromobenzyl)oxybenzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C19H16BrNO4 MolecularWeight: 402.23864

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC=CC=C1OCC2=CC(=CC=C2)Br

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC=CC=C1OCC2=CC(=CC=C2)Br

InChI

InChI=1S/C19H16BrNO4/c1-2-10-21-18(22)13-25-19(23)16-8-3-4-9-17(16)24-12-14-6-5-7-15(20)11-14/h1,3-9,11H,10,12-13H2,(H,21,22)