disodium (Z)-2,3-bis(phenylmethyl)but-2-enedioate

Systemtic Name: disodium (Z)-2,3-bis(phenylmethyl)but-2-enedioate Openeye Name: disodium (Z)-2,3-dibenzylbut-2-enedioate CAS Name: disodium (Z)-2,3-bis(phenylmethyl)-2-butenedioate IUPAC Name: disodium (Z)-2,3-dibenzylbut-2-enedioate Traditional Name: disodium (Z)-2,3-dibenzylbut-2-enedioate Formula: C18H14Na2O4 MolecularWeight: 340.2809

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=C(CC2=CC=CC=C2)C(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C/C(=C(\CC2=CC=CC=C2)/C(=O)[O-])/C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C18H16O4.2Na/c19-17(20)15(11-13-7-3-1-4-8-13)16(18(21)22)12-14-9-5-2-6-10-14;;/h1-10H,11-12H2,(H,19,20)(H,21,22);;/q;2*+1/p-2/b16-15-;;