7-chloranyl-2-piperazin-4-ium-1-yl-1,3-benzoxazole

Systemtic Name: 7-chloranyl-2-piperazin-4-ium-1-yl-1,3-benzoxazole Openeye Name: 7-chloro-2-piperazin-4-ium-1-yl-1,3-benzoxazole CAS Name: 7-chloro-2-(1-piperazin-4-iumyl)-1,3-benzoxazole IUPAC Name: 7-chloro-2-piperazin-4-ium-1-yl-1,3-benzoxazole Traditional Name: 7-chloro-2-piperazin-4-ium-1-yl-1,3-benzoxazole Formula: C11H13ClN3O+ MolecularWeight: 238.69342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC3=C(O2)C(=CC=C3)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC3=C(O2)C(=CC=C3)Cl

InChI

InChI=1S/C11H12ClN3O/c12-8-2-1-3-9-10(8)16-11(14-9)15-6-4-13-5-7-15/h1-3,13H,4-7H2/p+1