N-(2-hydroxyphenyl)-1-[2-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[2-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[2-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[2-[[1-(4-morpholin-4-iumyl)cyclohexyl]methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[2-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[2-keto-2-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]ethyl]piperidin-1-ium-4-carboxamide Formula: C25H40N4O4+2 MolecularWeight: 460.6095

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O)[NH+]4CCOCC4

InChI

InChI=1S/C25H38N4O4/c30-22-7-3-2-6-21(22)27-24(32)20-8-12-28(13-9-20)18-23(31)26-19-25(10-4-1-5-11-25)29-14-16-33-17-15-29/h2-3,6-7,20,30H,1,4-5,8-19H2,(H,26,31)(H,27,32)/p+2