2-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-8-carboxylic acid

Systemtic Name: 2-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-8-carboxylic acid Openeye Name: 2-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-8-carboxylic acid CAS Name: 2-methyl-4-[3-(4-morpholin-4-iumyl)propylamino]-8-quinolinecarboxylic acid IUPAC Name: 2-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-8-carboxylic acid Traditional Name: 2-methyl-4-(3-morpholin-4-ium-4-ylpropylamino)quinoline-8-carboxylic acid Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(=O)O)C(=C1)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(=O)O)C(=C1)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H23N3O3/c1-13-12-16(19-6-3-7-21-8-10-24-11-9-21)14-4-2-5-15(18(22)23)17(14)20-13/h2,4-5,12H,3,6-11H2,1H3,(H,19,20)(H,22,23)/p+1