(E)-2-(phenylmethyl)-3-prop-2-enyl-but-2-enedioate

Systemtic Name: (E)-2-(phenylmethyl)-3-prop-2-enyl-but-2-enedioate Openeye Name: (E)-2-allyl-3-benzyl-but-2-enedioate CAS Name: (E)-2-(phenylmethyl)-3-prop-2-enyl-2-butenedioate IUPAC Name: (E)-2-benzyl-3-prop-2-enylbut-2-enedioate Traditional Name: (E)-2-allyl-3-benzyl-but-2-enedioate Formula: C14H12O4-2 MolecularWeight: 244.24268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14O4/c1-2-6-11(13(15)16)12(14(17)18)9-10-7-4-3-5-8-10/h2-5,7-8H,1,6,9H2,(H,15,16)(H,17,18)/p-2/b12-11+