(E)-but-2-enedioic acid; 2,2-diphenylethanal

Systemtic Name: (E)-but-2-enedioic acid; 2,2-diphenylethanal Openeye Name: 2,2-diphenylacetaldehyde; fumaric acid CAS Name: (E)-2-butenedioic acid; 2,2-diphenylacetaldehyde IUPAC Name: (E)-but-2-enedioic acid; 2,2-diphenylacetaldehyde Traditional Name: 2,2-diphenylacetaldehyde; fumaric acid Formula: C18H16O5 MolecularWeight: 312.31664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C=O)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C=O)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H12O.C4H4O4/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13;5-3(6)1-2-4(7)8/h1-11,14H;1-2H,(H,5,6)(H,7,8)/b;2-1+