1-morpholin-4-yl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione

Systemtic Name: 1-morpholin-4-yl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione Openeye Name: 1-morpholino-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione CAS Name: 1-(4-morpholinyl)-5-[4-(2-pyridin-1-iumyl)-1-piperazinyl]pentane-1,5-dione IUPAC Name: 1-morpholin-4-yl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)pentane-1,5-dione Traditional Name: 1-morpholino-5-(4-pyridin-1-ium-2-ylpiperazino)pentane-1,5-dione Formula: C18H27N4O3+ MolecularWeight: 347.43198

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCCC(=O)N3CCOCC3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CCCC(=O)N3CCOCC3

InChI

InChI=1S/C18H26N4O3/c23-17(5-3-6-18(24)22-12-14-25-15-13-22)21-10-8-20(9-11-21)16-4-1-2-7-19-16/h1-2,4,7H,3,5-6,8-15H2/p+1