(phenylmethyl) 4-azanyl-4-[1-(2-cyanoethyl)-1,2,3,4-tetrazol-5-yl]butanoate

Systemtic Name: (phenylmethyl) 4-azanyl-4-[1-(2-cyanoethyl)-1,2,3,4-tetrazol-5-yl]butanoate Openeye Name: benzyl 4-amino-4-[1-(2-cyanoethyl)tetrazol-5-yl]butanoate CAS Name: 4-amino-4-[1-(2-cyanoethyl)-5-tetrazolyl]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-amino-4-[1-(2-cyanoethyl)tetrazol-5-yl]butanoate Traditional Name: 4-amino-4-[1-(2-cyanoethyl)tetrazol-5-yl]butyric acid benzyl ester Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(C2=NN=NN2CCC#N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC(C2=NN=NN2CCC#N)N

InChI

InChI=1S/C15H18N6O2/c16-9-4-10-21-15(18-19-20-21)13(17)7-8-14(22)23-11-12-5-2-1-3-6-12/h1-3,5-6,13H,4,7-8,10-11,17H2