(4-imidazol-1-yl-3-nitro-phenyl)-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]methanone

Systemtic Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]methanone Openeye Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone CAS Name: [4-(1-imidazolyl)-3-nitrophenyl]-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]methanone IUPAC Name: (4-imidazol-1-yl-3-nitrophenyl)-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]methanone Traditional Name: (4-imidazol-1-yl-3-nitro-phenyl)-[4-(1-phenyltetrazol-5-yl)piperazino]methanone Formula: C21H19N9O3 MolecularWeight: 445.43406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=NN2C3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)N5C=CN=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NN=NN2C3=CC=CC=C3)C(=O)C4=CC(=C(C=C4)N5C=CN=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H19N9O3/c31-20(16-6-7-18(19(14-16)30(32)33)28-9-8-22-15-28)26-10-12-27(13-11-26)21-23-24-25-29(21)17-4-2-1-3-5-17/h1-9,14-15H,10-13H2