1-[1-(5,6,7,8-tetrahydroquinazolin-2-ylamino)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-[1-(5,6,7,8-tetrahydroquinazolin-2-ylamino)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-[1-(5,6,7,8-tetrahydroquinazolin-2-ylamino)piperazin-1-ium-1-yl]ethanone CAS Name: 1-[1-(5,6,7,8-tetrahydroquinazolin-2-ylamino)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-[1-(5,6,7,8-tetrahydroquinazolin-2-ylamino)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-[1-(5,6,7,8-tetrahydroquinazolin-2-ylamino)piperazin-1-ium-1-yl]ethanone Formula: C14H22N5O+ MolecularWeight: 276.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+]1(CCNCC1)NC2=NC=C3CCCCC3=N2

Isomeric SMILES

CC(=O)[N+]1(CCNCC1)NC2=NC=C3CCCCC3=N2

InChI

InChI=1S/C14H22N5O/c1-11(20)19(8-6-15-7-9-19)18-14-16-10-12-4-2-3-5-13(12)17-14/h10,15H,2-9H2,1H3,(H,16,17,18)/q+1