sodium; buta-1,3-diene; 3-carboxybut-3-enoate; ethenylbenzene

Systemtic Name: sodium; buta-1,3-diene; 3-carboxybut-3-enoate; ethenylbenzene Openeye Name: sodium; buta-1,3-diene; 3-carboxybut-3-enoate; styrene CAS Name: sodium; buta-1,3-diene; 3-carboxy-3-butenoate; styrene IUPAC Name: sodium; buta-1,3-diene; 3-carboxybut-3-enoate; styrene Traditional Name: sodium; buta-1,3-diene; 3-carboxybut-3-enoate; styrene Formula: C17H19NaO4 MolecularWeight: 310.32013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8.C5H6O4.C4H6.Na/c1-2-8-6-4-3-5-7-8;1-3(5(8)9)2-4(6)7;1-3-4-2;/h2-7H,1H2;1-2H2,(H,6,7)(H,8,9);3-4H,1-2H2;/q;;;+1/p-1