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

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 4-bromanylbenzoate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 4-bromobenzoate Traditional Name: 4-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=C(C=C3)Br

Isomeric SMILES

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

InChI

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