4-methyl-8-(pyridin-3-ylmethyl)-2-(3-pyridin-4-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 4-methyl-8-(pyridin-3-ylmethyl)-2-(3-pyridin-4-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 4-methyl-8-(3-pyridylmethyl)-2-[3-(4-pyridyl)propyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 4-methyl-8-(3-pyridinylmethyl)-2-(3-pyridin-4-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 4-methyl-8-(pyridin-3-ylmethyl)-2-(3-pyridin-4-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 4-methyl-8-(3-pyridylmethyl)-2-[3-(4-pyridyl)propyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C22H28N5O2+ MolecularWeight: 394.49002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CN=CC=C3)CCCC4=CC=NC=C4

Isomeric SMILES

CN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CN=CC=C3)CCCC4=CC=NC=C4

InChI

InChI=1S/C22H27N5O2/c1-25-21(29)27(13-3-5-18-6-11-23-12-7-18)20(28)22(25)8-14-26(15-9-22)17-19-4-2-10-24-16-19/h2,4,6-7,10-12,16H,3,5,8-9,13-15,17H2,1H3/p+1