[4-[4-(2-cyano-2-methyl-hexanoyl)oxyphenyl]phenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate

Systemtic Name: [4-[4-(2-cyano-2-methyl-hexanoyl)oxyphenyl]phenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate Openeye Name: [4-[4-(2-cyano-2-methyl-hexanoyl)oxyphenyl]phenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate CAS Name: 4-[6-(1-oxoprop-2-enoxy)hexoxy]benzoic acid [4-[4-(2-cyano-2-methyl-1-oxohexoxy)phenyl]phenyl] ester IUPAC Name: [4-[4-(2-cyano-2-methylhexanoyl)oxyphenyl]phenyl] 4-(6-prop-2-enoyloxyhexoxy)benzoate Traditional Name: 4-(6-acryloyloxyhexoxy)benzoic acid [4-[4-(2-cyano-2-methyl-hexanoyl)oxyphenyl]phenyl] ester Formula: C36H39NO7 MolecularWeight: 597.69736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C#N)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCOC(=O)C=C

Isomeric SMILES

CCCCC(C)(C#N)C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCOC(=O)C=C

InChI

InChI=1S/C36H39NO7/c1-4-6-23-36(3,26-37)35(40)44-32-21-13-28(14-22-32)27-11-19-31(20-12-27)43-34(39)29-15-17-30(18-16-29)41-24-9-7-8-10-25-42-33(38)5-2/h5,11-22H,2,4,6-10,23-25H2,1,3H3