3-(2-piperazin-4-ium-1-ylethyl)-5-propoxy-1,2-benzoxazole

Systemtic Name: 3-(2-piperazin-4-ium-1-ylethyl)-5-propoxy-1,2-benzoxazole Openeye Name: 3-(2-piperazin-4-ium-1-ylethyl)-5-propoxy-1,2-benzoxazole CAS Name: 3-[2-(1-piperazin-4-iumyl)ethyl]-5-propoxy-1,2-benzoxazole IUPAC Name: 3-(2-piperazin-4-ium-1-ylethyl)-5-propoxy-1,2-benzoxazole Traditional Name: 3-(2-piperazin-4-ium-1-ylethyl)-5-propoxy-indoxazene Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)ON=C2CCN3CC[NH2+]CC3

Isomeric SMILES

CCCOC1=CC2=C(C=C1)ON=C2CCN3CC[NH2+]CC3

InChI

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