3-[(2-morpholin-4-ium-4-ylethylamino)-oxidanyl-methylidene]-5,6,7,8-tetrahydro-1H-quinoline-2,4-dione

Systemtic Name: 3-[(2-morpholin-4-ium-4-ylethylamino)-oxidanyl-methylidene]-5,6,7,8-tetrahydro-1H-quinoline-2,4-dione Openeye Name: 3-[hydroxy-(2-morpholin-4-ium-4-ylethylamino)methylene]-5,6,7,8-tetrahydro-1H-quinoline-2,4-dione CAS Name: 3-[hydroxy-[2-(4-morpholin-4-iumyl)ethylamino]methylidene]-5,6,7,8-tetrahydro-1H-quinoline-2,4-dione IUPAC Name: 3-[hydroxy-(2-morpholin-4-ium-4-ylethylamino)methylidene]-5,6,7,8-tetrahydro-1H-quinoline-2,4-dione Traditional Name: 3-[hydroxy-(2-morpholin-4-ium-4-ylethylamino)methylene]-5,6,7,8-tetrahydro-1H-quinoline-2,4-quinone Formula: C16H24N3O4+ MolecularWeight: 322.37946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=O)C(=C(NCC[NH+]3CCOCC3)O)C(=O)N2

Isomeric SMILES

C1CCC2=C(C1)C(=O)C(=C(NCC[NH+]3CCOCC3)O)C(=O)N2

InChI

InChI=1S/C16H23N3O4/c20-14-11-3-1-2-4-12(11)18-16(22)13(14)15(21)17-5-6-19-7-9-23-10-8-19/h17,21H,1-10H2,(H,18,22)/p+1