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

Systemtic Name: 2-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole CAS Name: 2-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-1,3-benzoxazole IUPAC Name: 2-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-1,3-benzoxazole Formula: C22H22N3O+ MolecularWeight: 344.42958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H21N3O/c1-2-9-19-17(6-1)7-5-8-18(19)16-24-12-14-25(15-13-24)22-23-20-10-3-4-11-21(20)26-22/h1-11H,12-16H2/p+1