ethanedioic acid; 2-methyl-6-pyrrol-1-yl-aniline

Systemtic Name: ethanedioic acid; 2-methyl-6-pyrrol-1-yl-aniline Openeye Name: 2-methyl-6-pyrrol-1-yl-aniline; oxalic acid CAS Name: 2-methyl-6-(1-pyrrolyl)aniline; oxalic acid IUPAC Name: 2-methyl-6-pyrrol-1-ylaniline; oxalic acid Traditional Name: (2-methyl-6-pyrrol-1-yl-phenyl)amine; oxalic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C=CC=C2)N.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=CC=C1)N2C=CC=C2)N.C(=O)(C(=O)O)O

InChI

InChI=1S/C11H12N2.C2H2O4/c1-9-5-4-6-10(11(9)12)13-7-2-3-8-13;3-1(4)2(5)6/h2-8H,12H2,1H3;(H,3,4)(H,5,6)