2-[4-[4-(diethylamino)quinazolin-3-ium-2-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[4-(diethylamino)quinazolin-3-ium-2-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[4-(diethylamino)quinazolin-3-ium-2-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[4-(diethylamino)-2-quinazolin-3-iumyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[4-(diethylamino)quinazolin-3-ium-2-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[4-(diethylamino)quinazolin-3-ium-2-yl]piperazino]ethanol Formula: C18H28N5O+ MolecularWeight: 330.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=[NH+]C(=NC2=CC=CC=C21)N3CCN(CC3)CCO

Isomeric SMILES

CCN(CC)C1=[NH+]C(=NC2=CC=CC=C21)N3CCN(CC3)CCO

InChI

InChI=1S/C18H27N5O/c1-3-22(4-2)17-15-7-5-6-8-16(15)19-18(20-17)23-11-9-21(10-12-23)13-14-24/h5-8,24H,3-4,9-14H2,1-2H3/p+1