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

Systemtic Name: 3-(2-piperazin-4-ium-1-ylethyl)-4-propoxy-1,2-benzoxazole Openeye Name: 3-(2-piperazin-4-ium-1-ylethyl)-4-propoxy-1,2-benzoxazole CAS Name: 3-[2-(1-piperazin-4-iumyl)ethyl]-4-propoxy-1,2-benzoxazole IUPAC Name: 3-(2-piperazin-4-ium-1-ylethyl)-4-propoxy-1,2-benzoxazole Traditional Name: 3-(2-piperazin-4-ium-1-ylethyl)-4-propoxy-indoxazene Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC2=C1C(=NO2)CCN3CC[NH2+]CC3

Isomeric SMILES

CCCOC1=CC=CC2=C1C(=NO2)CCN3CC[NH2+]CC3

InChI

InChI=1S/C16H23N3O2/c1-2-12-20-14-4-3-5-15-16(14)13(18-21-15)6-9-19-10-7-17-8-11-19/h3-5,17H,2,6-12H2,1H3/p+1