2-[[5-chloranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]methylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: 2-[[5-chloranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]methylcarbamoyl]piperidine-1-carboxylate Openeye Name: 2-[[5-chloro-2-(tetrazol-1-yl)phenyl]methylcarbamoyl]piperidine-1-carboxylate CAS Name: 2-[[[5-chloro-2-(1-tetrazolyl)phenyl]methylamino]-oxomethyl]-1-piperidinecarboxylate IUPAC Name: 2-[[5-chloro-2-(tetrazol-1-yl)phenyl]methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 2-[[5-chloro-2-(tetrazol-1-yl)benzyl]carbamoyl]piperidine-1-carboxylate Formula: C15H16ClN6O3- MolecularWeight: 363.77894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NCC2=C(C=CC(=C2)Cl)N3C=NN=N3)C(=O)[O-]

Isomeric SMILES

C1CCN(C(C1)C(=O)NCC2=C(C=CC(=C2)Cl)N3C=NN=N3)C(=O)[O-]

InChI

InChI=1S/C15H17ClN6O3/c16-11-4-5-12(22-9-18-19-20-22)10(7-11)8-17-14(23)13-3-1-2-6-21(13)15(24)25/h4-5,7,9,13H,1-3,6,8H2,(H,17,23)(H,24,25)/p-1