(5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-pyridin-1-ium-4-ylpiperazin-1-yl)carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-pyridin-1-ium-4-ylpiperazin-1-yl)carbonyl-piperidin-2-one Openeye Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)piperidin-2-one CAS Name: (5S)-1-[3-(4-morpholin-4-iumyl)propyl]-5-[oxo-[4-(4-pyridin-1-iumyl)-1-piperazinyl]methyl]-2-piperidinone IUPAC Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)piperidin-2-one Traditional Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-pyridin-1-ium-4-ylpiperazine-1-carbonyl)-2-piperidone Formula: C22H35N5O3+2 MolecularWeight: 417.545

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)N2CCN(CC2)C3=CC=[NH+]C=C3)CCC[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)N2CCN(CC2)C3=CC=[NH+]C=C3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C22H33N5O3/c28-21-3-2-19(18-27(21)9-1-8-24-14-16-30-17-15-24)22(29)26-12-10-25(11-13-26)20-4-6-23-7-5-20/h4-7,19H,1-3,8-18H2/p+2/t19-/m0/s1