(Z)-2-cyclohexyl-3-phenacyl-but-2-enedioate

Systemtic Name: (Z)-2-cyclohexyl-3-phenacyl-but-2-enedioate Openeye Name: (Z)-2-cyclohexyl-3-phenacyl-but-2-enedioate CAS Name: (Z)-2-cyclohexyl-3-phenacyl-2-butenedioate IUPAC Name: (Z)-2-cyclohexyl-3-phenacylbut-2-enedioate Traditional Name: (Z)-2-cyclohexyl-3-phenacyl-but-2-enedioate Formula: C18H18O5-2 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=C(CC(=O)C2=CC=CC=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CCC(CC1)/C(=C(\CC(=O)C2=CC=CC=C2)/C(=O)[O-])/C(=O)[O-]

InChI

InChI=1S/C18H20O5/c19-15(12-7-3-1-4-8-12)11-14(17(20)21)16(18(22)23)13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,20,21)(H,22,23)/p-2/b16-14-