[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 3-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 3-bromanylbenzoate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-keto-2-(4-phenylpiperazino)ethyl] ester Formula: C19H19BrN2O3 MolecularWeight: 403.26976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H19BrN2O3/c20-16-6-4-5-15(13-16)19(24)25-14-18(23)22-11-9-21(10-12-22)17-7-2-1-3-8-17/h1-8,13H,9-12,14H2