propyl 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-1H-quinoline-6-carboxylate

Systemtic Name: propyl 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-4-oxidanylidene-1H-quinoline-6-carboxylate Openeye Name: propyl 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-4-oxo-1H-quinoline-6-carboxylate CAS Name: 2-methyl-3-(4-morpholin-4-iumylmethyl)-4-oxo-1H-quinoline-6-carboxylic acid propyl ester IUPAC Name: propyl 2-methyl-3-(morpholin-4-ium-4-ylmethyl)-4-oxo-1H-quinoline-6-carboxylate Traditional Name: 4-keto-2-methyl-3-(morpholin-4-ium-4-ylmethyl)-1H-quinoline-6-carboxylic acid propyl ester Formula: C19H25N2O4+ MolecularWeight: 345.4128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O4/c1-3-8-25-19(23)14-4-5-17-15(11-14)18(22)16(13(2)20-17)12-21-6-9-24-10-7-21/h4-5,11H,3,6-10,12H2,1-2H3,(H,20,22)/p+1