2-(2-methoxy-4-methyl-phenyl)-3,5-bis(4-nitrophenyl)-1,2,3,4-tetrazol-2-ium

Systemtic Name: 2-(2-methoxy-4-methyl-phenyl)-3,5-bis(4-nitrophenyl)-1,2,3,4-tetrazol-2-ium Openeye Name: 2-(2-methoxy-4-methyl-phenyl)-3,5-bis(4-nitrophenyl)tetrazol-2-ium CAS Name: 2-(2-methoxy-4-methylphenyl)-3,5-bis(4-nitrophenyl)tetrazol-2-ium IUPAC Name: 2-(2-methoxy-4-methylphenyl)-3,5-bis(4-nitrophenyl)tetrazol-2-ium Traditional Name: 2-(2-methoxy-4-methyl-phenyl)-3,5-bis(4-nitrophenyl)tetrazol-2-ium Formula: C21H17N6O5+ MolecularWeight: 433.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+]2=NC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)[N+]2=NC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C21H17N6O5/c1-14-3-12-19(20(13-14)32-2)25-23-21(15-4-6-17(7-5-15)26(28)29)22-24(25)16-8-10-18(11-9-16)27(30)31/h3-13H,1-2H3/q+1