(E)-4-[4-[4-(4-methylpentoxy)phenyl]phenyl]but-3-en-2-one

Systemtic Name: (E)-4-[4-[4-(4-methylpentoxy)phenyl]phenyl]but-3-en-2-one Openeye Name: (E)-4-[4-(4-isohexyloxyphenyl)phenyl]but-3-en-2-one CAS Name: (E)-4-[4-[4-(4-methylpentoxy)phenyl]phenyl]-3-buten-2-one IUPAC Name: (E)-4-[4-[4-(4-methylpentoxy)phenyl]phenyl]but-3-en-2-one Traditional Name: (E)-4-[4-(4-isohexyloxyphenyl)phenyl]but-3-en-2-one Formula: C22H26O2 MolecularWeight: 322.44064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C=CC(=O)C

Isomeric SMILES

CC(C)CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)/C=C/C(=O)C

InChI

InChI=1S/C22H26O2/c1-17(2)5-4-16-24-22-14-12-21(13-15-22)20-10-8-19(9-11-20)7-6-18(3)23/h6-15,17H,4-5,16H2,1-3H3/b7-6+