barium(2+); 2,2,3,3-tetrakis[(E)-prop-1-enyl]butanedioate

Systemtic Name: barium(2+); 2,2,3,3-tetrakis[(E)-prop-1-enyl]butanedioate Openeye Name: barium(2+); 2,2,3,3-tetrakis[(E)-prop-1-enyl]butanedioate CAS Name: barium(2+); 2,2,3,3-tetrakis[(E)-prop-1-enyl]butanedioate IUPAC Name: barium(2+); 2,2,3,3-tetrakis[(E)-prop-1-enyl]butanedioate Traditional Name: barium(2+); 2,2,3,3-tetrakis[(E)-prop-1-enyl]succinate Formula: C16H20BaO4 MolecularWeight: 413.6546

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C=CC)(C(=O)[O-])C(C=CC)(C=CC)C(=O)[O-].[Ba+2]

Isomeric SMILES

C/C=C/C(C(C(=O)[O-])(/C=C/C)/C=C/C)(C(=O)[O-])/C=C/C.[Ba+2]

InChI

InChI=1S/C16H22O4.Ba/c1-5-9-15(10-6-2,13(17)18)16(11-7-3,12-8-4)14(19)20;/h5-12H,1-4H3,(H,17,18)(H,19,20);/q;+2/p-2/b9-5+,10-6+,11-7+,12-8+;