buta-1,3-diene; (E)-but-2-enedioic acid; ethenylbenzene; prop-2-enoic acid

Systemtic Name: buta-1,3-diene; (E)-but-2-enedioic acid; ethenylbenzene; prop-2-enoic acid Openeye Name: acrylic acid; buta-1,3-diene; fumaric acid; styrene CAS Name: buta-1,3-diene; (E)-2-butenedioic acid; 2-propenoic acid; styrene IUPAC Name: buta-1,3-diene; (E)-but-2-enedioic acid; prop-2-enoic acid; styrene Traditional Name: acrylic acid; buta-1,3-diene; fumaric acid; styrene Formula: C19H22O6 MolecularWeight: 346.37438

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=C.C=CC1=CC=CC=C1.C=CC(=O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C=CC=C.C=CC1=CC=CC=C1.C=CC(=O)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H8.C4H4O4.C4H6.C3H4O2/c1-2-8-6-4-3-5-7-8;5-3(6)1-2-4(7)8;1-3-4-2;1-2-3(4)5/h2-7H,1H2;1-2H,(H,5,6)(H,7,8);3-4H,1-2H2;2H,1H2,(H,4,5)/b;2-1+;;