(3S)-3-methyl-1-[2-nitro-4-(1,2,3,4-tetrazol-1-yl)phenyl]piperidine

Systemtic Name: (3S)-3-methyl-1-[2-nitro-4-(1,2,3,4-tetrazol-1-yl)phenyl]piperidine Openeye Name: (3S)-3-methyl-1-[2-nitro-4-(tetrazol-1-yl)phenyl]piperidine CAS Name: (3S)-3-methyl-1-[2-nitro-4-(1-tetrazolyl)phenyl]piperidine IUPAC Name: (3S)-3-methyl-1-[2-nitro-4-(tetrazol-1-yl)phenyl]piperidine Traditional Name: (3S)-3-methyl-1-[2-nitro-4-(tetrazol-1-yl)phenyl]piperidine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)N3C=NN=N3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C=C(C=C2)N3C=NN=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H16N6O2/c1-10-3-2-6-17(8-10)12-5-4-11(7-13(12)19(20)21)18-9-14-15-16-18/h4-5,7,9-10H,2-3,6,8H2,1H3/t10-/m0/s1