4-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole

Systemtic Name: 4-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole Openeye Name: 4-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole CAS Name: 4-ethoxy-3-[2-(1-piperazin-4-iumyl)ethyl]-1,2-benzoxazole IUPAC Name: 4-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)-1,2-benzoxazole Traditional Name: 4-ethoxy-3-(2-piperazin-4-ium-1-ylethyl)indoxazene Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1C(=NO2)CCN3CC[NH2+]CC3

Isomeric SMILES

CCOC1=CC=CC2=C1C(=NO2)CCN3CC[NH2+]CC3

InChI

InChI=1S/C15H21N3O2/c1-2-19-13-4-3-5-14-15(13)12(17-20-14)6-9-18-10-7-16-8-11-18/h3-5,16H,2,6-11H2,1H3/p+1