(E)-2-(2-butoxyethyl)-3-(2-oxidanylidene-4-phenyl-butyl)but-2-enedioic acid

Systemtic Name: (E)-2-(2-butoxyethyl)-3-(2-oxidanylidene-4-phenyl-butyl)but-2-enedioic acid Openeye Name: (E)-2-(2-butoxyethyl)-3-(2-oxo-4-phenyl-butyl)but-2-enedioic acid CAS Name: (E)-2-(2-butoxyethyl)-3-(2-oxo-4-phenylbutyl)-2-butenedioic acid IUPAC Name: (E)-2-(2-butoxyethyl)-3-(2-oxo-4-phenylbutyl)but-2-enedioic acid Traditional Name: (E)-2-(2-butoxyethyl)-3-(2-keto-4-phenyl-butyl)but-2-enedioic acid Formula: C20H26O6 MolecularWeight: 362.41684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC(=C(CC(=O)CCC1=CC=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCOCC/C(=C(/CC(=O)CCC1=CC=CC=C1)\C(=O)O)/C(=O)O

InChI

InChI=1S/C20H26O6/c1-2-3-12-26-13-11-17(19(22)23)18(20(24)25)14-16(21)10-9-15-7-5-4-6-8-15/h4-8H,2-3,9-14H2,1H3,(H,22,23)(H,24,25)/b18-17+