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

Systemtic Name: 2-[[5-chloranyl-2-(1,2,3,4-tetrazol-1-yl)phenyl]methylcarbamoyl]azetidine-1-carboxylate Openeye Name: 2-[[5-chloro-2-(tetrazol-1-yl)phenyl]methylcarbamoyl]azetidine-1-carboxylate CAS Name: 2-[[[5-chloro-2-(1-tetrazolyl)phenyl]methylamino]-oxomethyl]-1-azetidinecarboxylate IUPAC Name: 2-[[5-chloro-2-(tetrazol-1-yl)phenyl]methylcarbamoyl]azetidine-1-carboxylate Traditional Name: 2-[[5-chloro-2-(tetrazol-1-yl)benzyl]carbamoyl]azetidine-1-carboxylate Formula: C13H12ClN6O3- MolecularWeight: 335.72578

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1C(=O)NCC2=C(C=CC(=C2)Cl)N3C=NN=N3)C(=O)[O-]

Isomeric SMILES

C1CN(C1C(=O)NCC2=C(C=CC(=C2)Cl)N3C=NN=N3)C(=O)[O-]

InChI

InChI=1S/C13H13ClN6O3/c14-9-1-2-10(20-7-16-17-18-20)8(5-9)6-15-12(21)11-3-4-19(11)13(22)23/h1-2,5,7,11H,3-4,6H2,(H,15,21)(H,22,23)/p-1