(E)-2-(phenylmethyl)-3-propan-2-yl-but-2-enedioate

Systemtic Name: (E)-2-(phenylmethyl)-3-propan-2-yl-but-2-enedioate Openeye Name: (E)-2-benzyl-3-isopropyl-but-2-enedioate CAS Name: (E)-2-(phenylmethyl)-3-propan-2-yl-2-butenedioate IUPAC Name: (E)-2-benzyl-3-propan-2-ylbut-2-enedioate Traditional Name: (E)-2-benzyl-3-isopropyl-but-2-enedioate Formula: C14H14O4-2 MolecularWeight: 246.25856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(CC1=CC=CC=C1)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C14H16O4/c1-9(2)12(14(17)18)11(13(15)16)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,15,16)(H,17,18)/p-2/b12-11+