N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide Openeye Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4-morpholino-pyridin-1-ium-2-carboxamide CAS Name: N-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-4-(4-morpholinyl)-2-pyridin-1-iumcarboxamide IUPAC Name: N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-4-morpholin-4-ylpyridin-1-ium-2-carboxamide Traditional Name: N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-methyl-4-morpholino-pyridin-1-ium-2-carboxamide Formula: C18H29N5O3+2 MolecularWeight: 363.45456

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=[NH+]C=CC(=C2)N3CCOCC3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=[NH+]C=CC(=C2)N3CCOCC3

InChI

InChI=1S/C18H27N5O3/c1-20-5-7-23(8-6-20)17(24)14-21(2)18(25)16-13-15(3-4-19-16)22-9-11-26-12-10-22/h3-4,13H,5-12,14H2,1-2H3/p+2