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

Systemtic Name: methyl 3-methyl-2-[2-(5-oxidanylidene-4-phenyl-1,2,3,4-tetrazol-1-yl)ethanoylamino]pentanoate Openeye Name: methyl 3-methyl-2-[[2-(5-oxo-4-phenyl-tetrazol-1-yl)acetyl]amino]pentanoate CAS Name: 3-methyl-2-[[1-oxo-2-(5-oxo-4-phenyl-1-tetrazolyl)ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[2-(5-oxo-4-phenyltetrazol-1-yl)acetyl]amino]pentanoate Traditional Name: 2-[[2-(5-keto-4-phenyl-tetrazol-1-yl)acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CN1C(=O)N(N=N1)C2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CN1C(=O)N(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C16H21N5O4/c1-4-11(2)14(15(23)25-3)17-13(22)10-20-16(24)21(19-18-20)12-8-6-5-7-9-12/h5-9,11,14H,4,10H2,1-3H3,(H,17,22)