(2S)-N-(2-methyl-5-nitro-phenyl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)propanamide

Systemtic Name: (2S)-N-(2-methyl-5-nitro-phenyl)-2-(5-phenyl-1,2,3,4-tetrazol-2-yl)propanamide Openeye Name: (2S)-N-(2-methyl-5-nitro-phenyl)-2-(5-phenyltetrazol-2-yl)propanamide CAS Name: (2S)-N-(2-methyl-5-nitrophenyl)-2-(5-phenyl-2-tetrazolyl)propanamide IUPAC Name: (2S)-N-(2-methyl-5-nitrophenyl)-2-(5-phenyltetrazol-2-yl)propanamide Traditional Name: (2S)-N-(2-methyl-5-nitro-phenyl)-2-(5-phenyltetrazol-2-yl)propionamide Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C(C)N2N=C(N=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)[C@H](C)N2N=C(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C17H16N6O3/c1-11-8-9-14(23(25)26)10-15(11)18-17(24)12(2)22-20-16(19-21-22)13-6-4-3-5-7-13/h3-10,12H,1-2H3,(H,18,24)/t12-/m0/s1