ethanedioic acid; N-methyl-3-quinolin-6-yl-prop-2-yn-1-amine

Systemtic Name: ethanedioic acid; N-methyl-3-quinolin-6-yl-prop-2-yn-1-amine Openeye Name: N-methyl-3-(6-quinolyl)prop-2-yn-1-amine; oxalic acid CAS Name: N-methyl-3-(6-quinolinyl)-2-propyn-1-amine; oxalic acid IUPAC Name: N-methyl-3-quinolin-6-ylprop-2-yn-1-amine; oxalic acid Traditional Name: methyl-[3-(6-quinolyl)prop-2-ynyl]amine; oxalic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CNCC#CC1=CC2=C(C=C1)N=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CNCC#CC1=CC2=C(C=C1)N=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H12N2.C2H2O4/c1-14-8-2-4-11-6-7-13-12(10-11)5-3-9-15-13;3-1(4)2(5)6/h3,5-7,9-10,14H,8H2,1H3;(H,3,4)(H,5,6)