2-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole

Systemtic Name: 2-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-(8-quinolylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole CAS Name: 2-[4-(8-quinolinylmethyl)-1-piperazin-4-iumyl]-1,3-benzoxazole IUPAC Name: 2-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-(8-quinolylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole Formula: C21H21N4O+ MolecularWeight: 345.41764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=C2N=CC=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=C2N=CC=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C21H20N4O/c1-2-9-19-18(8-1)23-21(26-19)25-13-11-24(12-14-25)15-17-6-3-5-16-7-4-10-22-20(16)17/h1-10H,11-15H2/p+1