ethanedioic acid; 8-methylidene-3-[(3-oxidanylpropylamino)methyl]quinolin-2-one

Systemtic Name: ethanedioic acid; 8-methylidene-3-[(3-oxidanylpropylamino)methyl]quinolin-2-one Openeye Name: 3-[(3-hydroxypropylamino)methyl]-8-methylene-quinolin-2-one; oxalic acid CAS Name: 3-[(3-hydroxypropylamino)methyl]-8-methylene-2-quinolinone; oxalic acid IUPAC Name: 3-[(3-hydroxypropylamino)methyl]-8-methylidenequinolin-2-one; oxalic acid Traditional Name: 3-[(3-hydroxypropylamino)methyl]-8-methylene-carbostyril; oxalic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C=CC=C2C1=NC(=O)C(=C2)CNCCCO.C(=O)(C(=O)O)O

Isomeric SMILES

C=C1C=CC=C2C1=NC(=O)C(=C2)CNCCCO.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H16N2O2.C2H2O4/c1-10-4-2-5-11-8-12(9-15-6-3-7-17)14(18)16-13(10)11;3-1(4)2(5)6/h2,4-5,8,15,17H,1,3,6-7,9H2;(H,3,4)(H,5,6)