methyl 3-methyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]pentanoate Openeye Name: methyl 3-methyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]pentanoate CAS Name: 3-methyl-2-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]pentanoate Traditional Name: 3-methyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]valeric acid methyl ester Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H21N5O3/c1-4-11(2)14(16(23)24-3)17-13(22)10-21-19-15(18-20-21)12-8-6-5-7-9-12/h5-9,11,14H,4,10H2,1-3H3,(H,17,22)