N-[(2S)-octan-2-yl]-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanamide

Systemtic Name: N-[(2S)-octan-2-yl]-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanamide Openeye Name: N-[(1S)-1-methylheptyl]-2-(5-phenyltetrazol-2-yl)acetamide CAS Name: N-[(2S)-octan-2-yl]-2-(5-phenyl-2-tetrazolyl)acetamide IUPAC Name: N-[(2S)-octan-2-yl]-2-(5-phenyltetrazol-2-yl)acetamide Traditional Name: N-[(1S)-1-methylheptyl]-2-(5-phenyltetrazol-2-yl)acetamide Formula: C17H25N5O MolecularWeight: 315.4133

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

Isomeric SMILES

CCCCCC[C@H](C)NC(=O)CN1N=C(N=N1)C2=CC=CC=C2

InChI

InChI=1S/C17H25N5O/c1-3-4-5-7-10-14(2)18-16(23)13-22-20-17(19-21-22)15-11-8-6-9-12-15/h6,8-9,11-12,14H,3-5,7,10,13H2,1-2H3,(H,18,23)/t14-/m0/s1