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

Systemtic Name: phenyl-[4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: phenyl-[4-[(5-phenyltetrazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: phenyl-[4-[(5-phenyl-2-tetrazolyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: phenyl-[4-[(5-phenyltetrazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: phenyl-[4-[(5-phenyltetrazol-2-yl)methyl]piperazin-4-ium-1-yl]methanone Formula: C19H21N6O+ MolecularWeight: 349.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2N=C(N=N2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CN2N=C(N=N2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H20N6O/c26-19(17-9-5-2-6-10-17)24-13-11-23(12-14-24)15-25-21-18(20-22-25)16-7-3-1-4-8-16/h1-10H,11-15H2/p+1