4-(6-methyl-5-oxidanyl-4-oxidanylidene-3H-pyridin-1-ium-1-yl)-N-[2-[4-(6-methyl-5-oxidanyl-4-oxidanylidene-3H-pyridin-1-ium-1-yl)butanoylamino]ethyl]butanamide

Systemtic Name: 4-(6-methyl-5-oxidanyl-4-oxidanylidene-3H-pyridin-1-ium-1-yl)-N-[2-[4-(6-methyl-5-oxidanyl-4-oxidanylidene-3H-pyridin-1-ium-1-yl)butanoylamino]ethyl]butanamide Openeye Name: 4-(5-hydroxy-6-methyl-4-oxo-3H-pyridin-1-ium-1-yl)-N-[2-[4-(5-hydroxy-6-methyl-4-oxo-3H-pyridin-1-ium-1-yl)butanoylamino]ethyl]butanamide CAS Name: 4-(5-hydroxy-6-methyl-4-oxo-3H-pyridin-1-ium-1-yl)-N-[2-[[4-(5-hydroxy-6-methyl-4-oxo-3H-pyridin-1-ium-1-yl)-1-oxobutyl]amino]ethyl]butanamide IUPAC Name: 4-(5-hydroxy-6-methyl-4-oxo-3H-pyridin-1-ium-1-yl)-N-[2-[4-(5-hydroxy-6-methyl-4-oxo-3H-pyridin-1-ium-1-yl)butanoylamino]ethyl]butanamide Traditional Name: 4-(5-hydroxy-4-keto-6-methyl-3H-pyridin-1-ium-1-yl)-N-[2-[4-(5-hydroxy-4-keto-6-methyl-3H-pyridin-1-ium-1-yl)butanoylamino]ethyl]butyramide Formula: C22H32N4O6+2 MolecularWeight: 448.51268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC=[N+]1CCCC(=O)NCCNC(=O)CCC[N+]2=CCC(=O)C(=C2C)O)O

Isomeric SMILES

CC1=C(C(=O)CC=[N+]1CCCC(=O)NCCNC(=O)CCC[N+]2=CCC(=O)C(=C2C)O)O

InChI

InChI=1S/C22H30N4O6/c1-15-21(31)17(27)7-13-25(15)11-3-5-19(29)23-9-10-24-20(30)6-4-12-26-14-8-18(28)22(32)16(26)2/h13-14H,3-12H2,1-2H3,(H2-2,23,24,29,30,31,32)/p+2