(E)-but-2-enedioic acid; 2-naphthalen-2-ylpyridine-3,4-diamine

Systemtic Name: (E)-but-2-enedioic acid; 2-naphthalen-2-ylpyridine-3,4-diamine Openeye Name: fumaric acid; 2-(2-naphthyl)pyridine-3,4-diamine CAS Name: (E)-2-butenedioic acid; 2-(2-naphthalenyl)pyridine-3,4-diamine IUPAC Name: (E)-but-2-enedioic acid; 2-naphthalen-2-ylpyridine-3,4-diamine Traditional Name: [3-amino-2-(2-naphthyl)-4-pyridyl]amine; fumaric acid Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NC=CC(=C3N)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NC=CC(=C3N)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H13N3.C4H4O4/c16-13-7-8-18-15(14(13)17)12-6-5-10-3-1-2-4-11(10)9-12;5-3(6)1-2-4(7)8/h1-9H,17H2,(H2,16,18);1-2H,(H,5,6)(H,7,8)/b;2-1+