cyclohexyl-methyl-[[5-[(1-morpholin-4-ium-4-ylcyclohexyl)methylcarbamoyl]-6-oxidanylidene-1H-pyridin-2-yl]methyl]azanium

Systemtic Name: cyclohexyl-methyl-[[5-[(1-morpholin-4-ium-4-ylcyclohexyl)methylcarbamoyl]-6-oxidanylidene-1H-pyridin-2-yl]methyl]azanium Openeye Name: cyclohexyl-methyl-[[5-[(1-morpholin-4-ium-4-ylcyclohexyl)methylcarbamoyl]-6-oxo-1H-pyridin-2-yl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[5-[[[1-(4-morpholin-4-iumyl)cyclohexyl]methylamino]-oxomethyl]-6-oxo-1H-pyridin-2-yl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[5-[(1-morpholin-4-ium-4-ylcyclohexyl)methylcarbamoyl]-6-oxo-1H-pyridin-2-yl]methyl]azanium Traditional Name: cyclohexyl-[[6-keto-5-[(1-morpholin-4-ium-4-ylcyclohexyl)methylcarbamoyl]-1H-pyridin-2-yl]methyl]-methyl-ammonium Formula: C25H42N4O3+2 MolecularWeight: 446.62598

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C(=O)N1)C(=O)NCC2(CCCCC2)[NH+]3CCOCC3)C4CCCCC4

Isomeric SMILES

C[NH+](CC1=CC=C(C(=O)N1)C(=O)NCC2(CCCCC2)[NH+]3CCOCC3)C4CCCCC4

InChI

InChI=1S/C25H40N4O3/c1-28(21-8-4-2-5-9-21)18-20-10-11-22(24(31)27-20)23(30)26-19-25(12-6-3-7-13-25)29-14-16-32-17-15-29/h10-11,21H,2-9,12-19H2,1H3,(H,26,30)(H,27,31)/p+2