6-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: 6-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: 6-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide CAS Name: 6-methoxy-N-[3-(4-morpholin-4-iumyl)propyl]-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: 6-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 4-keto-6-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)-1H-quinoline-3-carboxamide Formula: C18H24N3O4+ MolecularWeight: 346.40086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H23N3O4/c1-24-13-3-4-16-14(11-13)17(22)15(12-20-16)18(23)19-5-2-6-21-7-9-25-10-8-21/h3-4,11-12H,2,5-10H2,1H3,(H,19,23)(H,20,22)/p+1