[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 3-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl] 3-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-(tetrazol-1-yl)benzoate CAS Name: 3-(1-tetrazolyl)benzoic acid [2-oxo-2-(4-phenyl-1-piperazinyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 3-(tetrazol-1-yl)benzoate Traditional Name: 3-(tetrazol-1-yl)benzoic acid [2-keto-2-(4-phenylpiperazino)ethyl] ester Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=CC=C3)N4C=NN=N4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)COC(=O)C3=CC(=CC=C3)N4C=NN=N4

InChI

InChI=1S/C20H20N6O3/c27-19(25-11-9-24(10-12-25)17-6-2-1-3-7-17)14-29-20(28)16-5-4-8-18(13-16)26-15-21-22-23-26/h1-8,13,15H,9-12,14H2