calcium; (E)-but-2-enedioate; ethenylbenzene

Systemtic Name: calcium; (E)-but-2-enedioate; ethenylbenzene Openeye Name: calcium; (E)-but-2-enedioate; styrene CAS Name: calcium; (E)-2-butenedioate; styrene IUPAC Name: calcium; (E)-but-2-enedioate; styrene Traditional Name: calcium styrene fumarate Formula: C12H10CaO4 MolecularWeight: 258.2834

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1.C(=CC(=O)[O-])C(=O)[O-].[Ca+2]

Isomeric SMILES

C=CC1=CC=CC=C1.C(=C/C(=O)[O-])\C(=O)[O-].[Ca+2]

InChI

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