disodium (Z)-2-(2,3-dihydro-1H-inden-2-yl)-3-propan-2-yl-but-2-enedioate

Systemtic Name: disodium (Z)-2-(2,3-dihydro-1H-inden-2-yl)-3-propan-2-yl-but-2-enedioate Openeye Name: disodium (Z)-2-indan-2-yl-3-isopropyl-but-2-enedioate CAS Name: disodium (Z)-2-(2,3-dihydro-1H-inden-2-yl)-3-propan-2-yl-2-butenedioate IUPAC Name: disodium (Z)-2-(2,3-dihydro-1H-inden-2-yl)-3-propan-2-ylbut-2-enedioate Traditional Name: disodium (Z)-2-indan-2-yl-3-isopropyl-but-2-enedioate Formula: C16H16Na2O4 MolecularWeight: 318.27538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(C1CC2=CC=CC=C2C1)C(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC(C)/C(=C(\C1CC2=CC=CC=C2C1)/C(=O)[O-])/C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C16H18O4.2Na/c1-9(2)13(15(17)18)14(16(19)20)12-7-10-5-3-4-6-11(10)8-12;;/h3-6,9,12H,7-8H2,1-2H3,(H,17,18)(H,19,20);;/q;2*+1/p-2/b14-13-;;