[2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 4-bromanylbenzoate Openeye Name: [2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxo-1-phenylethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrNO3/c19-14-8-6-13(7-9-14)18(22)23-16(12-4-2-1-3-5-12)17(21)20-15-10-11-15/h1-9,15-16H,10-11H2,(H,20,21)