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

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)C1=CC=C(C=C1)N2C=NN=N2

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)C1=CC=C(C=C1)N2C=NN=N2

InChI

InChI=1S/C14H17N5O3/c1-14(2,3)16-12(20)8-22-13(21)10-4-6-11(7-5-10)19-9-15-17-18-19/h4-7,9H,8H2,1-3H3,(H,16,20)