ethyl (2S)-3-phenyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]propanoate

Systemtic Name: ethyl (2S)-3-phenyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]propanoate Openeye Name: ethyl (2S)-3-phenyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]propanoate CAS Name: (2S)-2-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-phenyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]propanoate Traditional Name: (2S)-3-phenyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]propionic acid ethyl ester Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N5O3/c1-2-28-20(27)17(13-15-9-5-3-6-10-15)21-18(26)14-25-23-19(22-24-25)16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3,(H,21,26)/t17-/m0/s1