(E)-2-(2-butoxyethyl)-3-phenacyl-but-2-enedioate

Systemtic Name: (E)-2-(2-butoxyethyl)-3-phenacyl-but-2-enedioate Openeye Name: (E)-2-(2-butoxyethyl)-3-phenacyl-but-2-enedioate CAS Name: (E)-2-(2-butoxyethyl)-3-phenacyl-2-butenedioate IUPAC Name: (E)-2-(2-butoxyethyl)-3-phenacylbut-2-enedioate Traditional Name: (E)-2-(2-butoxyethyl)-3-phenacyl-but-2-enedioate Formula: C18H20O6-2 MolecularWeight: 332.3478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O6/c1-2-3-10-24-11-9-14(17(20)21)15(18(22)23)12-16(19)13-7-5-4-6-8-13/h4-8H,2-3,9-12H2,1H3,(H,20,21)(H,22,23)/p-2/b15-14+