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

Systemtic Name: N-(4-fluorophenyl)-4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(4-fluorophenyl)-4-[(1-phenyltetrazol-5-yl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-(4-fluorophenyl)-4-[(1-phenyl-5-tetrazolyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(4-fluorophenyl)-4-[(1-phenyltetrazol-5-yl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(4-fluorophenyl)-4-[(1-phenyltetrazol-5-yl)methyl]piperazin-4-ium-1-carboxamide Formula: C19H21FN7O+ MolecularWeight: 382.414743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NN=NN2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=NN=NN2C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C19H20FN7O/c20-15-6-8-16(9-7-15)21-19(28)26-12-10-25(11-13-26)14-18-22-23-24-27(18)17-4-2-1-3-5-17/h1-9H,10-14H2,(H,21,28)/p+1