5,7-bis(chloranyl)-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole

Systemtic Name: 5,7-bis(chloranyl)-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole Openeye Name: 5,7-dichloro-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole CAS Name: 5,7-dichloro-3-[2-(1-piperazin-4-iumyl)ethyl]-1,2-benzoxazole IUPAC Name: 5,7-dichloro-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole Traditional Name: 5,7-dichloro-3-(2-piperazin-4-ium-1-ylethyl)indoxazene Formula: C13H16Cl2N3O+ MolecularWeight: 301.19164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCC2=NOC3=C(C=C(C=C23)Cl)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)CCC2=NOC3=C(C=C(C=C23)Cl)Cl

InChI

InChI=1S/C13H15Cl2N3O/c14-9-7-10-12(17-19-13(10)11(15)8-9)1-4-18-5-2-16-3-6-18/h7-8,16H,1-6H2/p+1