(E)-but-2-enedioic acid; 1H-indol-3-amine

Systemtic Name: (E)-but-2-enedioic acid; 1H-indol-3-amine Openeye Name: fumaric acid; 1H-indol-3-amine CAS Name: (E)-2-butenedioic acid; 1H-indol-3-amine IUPAC Name: (E)-but-2-enedioic acid; 1H-indol-3-amine Traditional Name: fumaric acid; 1H-indol-3-ylamine Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H8N2.C4H4O4/c9-7-5-10-8-4-2-1-3-6(7)8;5-3(6)1-2-4(7)8/h1-5,10H,9H2;1-2H,(H,5,6)(H,7,8)/b;2-1+