sodium; buta-1,3-diene; ethenylbenzene; (E)-4-oxidanyl-4-oxidanylidene-but-2-enoate

Systemtic Name: sodium; buta-1,3-diene; ethenylbenzene; (E)-4-oxidanyl-4-oxidanylidene-but-2-enoate Openeye Name: sodium; buta-1,3-diene; (E)-4-hydroxy-4-oxo-but-2-enoate; styrene CAS Name: sodium; buta-1,3-diene; (E)-4-hydroxy-4-oxo-2-butenoate; styrene IUPAC Name: sodium; buta-1,3-diene; (E)-4-hydroxy-4-oxobut-2-enoate; styrene Traditional Name: sodium; buta-1,3-diene; (E)-4-hydroxy-4-keto-but-2-enoate; styrene Formula: C16H17NaO4 MolecularWeight: 296.29355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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