1-[[1-(3-nitro-4-piperidin-1-yl-phenyl)pyrrol-2-yl]methylideneamino]-1,2,3,4-tetrazol-5-amine

Systemtic Name: 1-[[1-(3-nitro-4-piperidin-1-yl-phenyl)pyrrol-2-yl]methylideneamino]-1,2,3,4-tetrazol-5-amine Openeye Name: 1-[[1-[3-nitro-4-(1-piperidyl)phenyl]pyrrol-2-yl]methyleneamino]tetrazol-5-amine CAS Name: 1-[[1-[3-nitro-4-(1-piperidinyl)phenyl]-2-pyrrolyl]methylideneamino]-5-tetrazolamine IUPAC Name: 1-[[1-(3-nitro-4-piperidin-1-ylphenyl)pyrrol-2-yl]methylideneamino]tetrazol-5-amine Traditional Name: [1-[[1-(3-nitro-4-piperidino-phenyl)pyrrol-2-yl]methyleneamino]tetrazol-5-yl]amine Formula: C17H19N9O2 MolecularWeight: 381.39186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)N3C=CC=C3C=NN4C(=NN=N4)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)N3C=CC=C3C=NN4C(=NN=N4)N)[N+](=O)[O-]

InChI

InChI=1S/C17H19N9O2/c18-17-20-21-22-25(17)19-12-14-5-4-10-24(14)13-6-7-15(16(11-13)26(27)28)23-8-2-1-3-9-23/h4-7,10-12H,1-3,8-9H2,(H2,18,20,22)