[2,3,6-trimethyl-5-[(E)-3-methyl-4-(4-nitrophenoxy)but-2-enyl]-4-oxidanyl-phenyl] ethanoate

Systemtic Name: [2,3,6-trimethyl-5-[(E)-3-methyl-4-(4-nitrophenoxy)but-2-enyl]-4-oxidanyl-phenyl] ethanoate Openeye Name: [4-hydroxy-2,3,6-trimethyl-5-[(E)-3-methyl-4-(4-nitrophenoxy)but-2-enyl]phenyl] acetate CAS Name: acetic acid [4-hydroxy-2,3,6-trimethyl-5-[(E)-3-methyl-4-(4-nitrophenoxy)but-2-enyl]phenyl] ester IUPAC Name: [4-hydroxy-2,3,6-trimethyl-5-[(E)-3-methyl-4-(4-nitrophenoxy)but-2-enyl]phenyl] acetate Traditional Name: acetic acid [4-hydroxy-2,3,6-trimethyl-5-[(E)-3-methyl-4-(4-nitrophenoxy)but-2-enyl]phenyl] ester Formula: C22H25NO6 MolecularWeight: 399.437

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1O)CC=C(C)COC2=CC=C(C=C2)[N+](=O)[O-])C)OC(=O)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1O)C/C=C(\C)/COC2=CC=C(C=C2)[N+](=O)[O-])C)OC(=O)C)C

InChI

InChI=1S/C22H25NO6/c1-13(12-28-19-9-7-18(8-10-19)23(26)27)6-11-20-16(4)22(29-17(5)24)15(3)14(2)21(20)25/h6-10,25H,11-12H2,1-5H3/b13-6+