2-ethyl-4-piperazin-4-ium-1-yl-7,8-dihydro-[1,4]dioxino[2,3-g]quinazoline

Systemtic Name: 2-ethyl-4-piperazin-4-ium-1-yl-7,8-dihydro-[1,4]dioxino[2,3-g]quinazoline Openeye Name: 2-ethyl-4-piperazin-4-ium-1-yl-7,8-dihydro-[1,4]dioxino[2,3-g]quinazoline CAS Name: 2-ethyl-4-(1-piperazin-4-iumyl)-7,8-dihydro-[1,4]dioxino[2,3-g]quinazoline IUPAC Name: 2-ethyl-4-piperazin-4-ium-1-yl-7,8-dihydro-[1,4]dioxino[2,3-g]quinazoline Traditional Name: 2-ethyl-4-piperazin-4-ium-1-yl-7,8-dihydro-[1,4]dioxino[2,3-g]quinazoline Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC3=C(C=C2C(=N1)N4CC[NH2+]CC4)OCCO3

Isomeric SMILES

CCC1=NC2=CC3=C(C=C2C(=N1)N4CC[NH2+]CC4)OCCO3

InChI

InChI=1S/C16H20N4O2/c1-2-15-18-12-10-14-13(21-7-8-22-14)9-11(12)16(19-15)20-5-3-17-4-6-20/h9-10,17H,2-8H2,1H3/p+1