2-phenyl-4-(piperazine-1,4-diium-1-ylmethyl)-1,3-oxazole

Systemtic Name: 2-phenyl-4-(piperazine-1,4-diium-1-ylmethyl)-1,3-oxazole Openeye Name: 2-phenyl-4-(piperazine-1,4-diium-1-ylmethyl)oxazole CAS Name: 2-phenyl-4-(1-piperazine-1,4-diiumylmethyl)oxazole IUPAC Name: 2-phenyl-4-(piperazine-1,4-diium-1-ylmethyl)-1,3-oxazole Traditional Name: 2-phenyl-4-(piperazine-1,4-diium-1-ylmethyl)oxazole Formula: C14H19N3O+2 MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CC2=COC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CC2=COC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C14H17N3O/c1-2-4-12(5-3-1)14-16-13(11-18-14)10-17-8-6-15-7-9-17/h1-5,11,15H,6-10H2/p+2