ethene; 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]cyclohex-3-en-1-one

Systemtic Name: ethene; 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]cyclohex-3-en-1-one Openeye Name: 3-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]cyclohex-3-en-1-one; ethylene CAS Name: ethene; 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-cyclohex-3-enone IUPAC Name: ethene; 3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohex-3-en-1-one Traditional Name: 3-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]cyclohex-3-en-1-one; ethylene Formula: C30H40O2 MolecularWeight: 432.6374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CCCC(=O)C2)OCC3=CC=CC=C3.C=C

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CCCC(=O)C2)OCC3=CC=CC=C3.C=C

InChI

InChI=1S/C28H36O2.C2H4/c1-4-5-6-10-18-28(2,3)24-16-17-26(23-14-11-15-25(29)19-23)27(20-24)30-21-22-12-8-7-9-13-22;1-2/h7-9,12-14,16-17,20H,4-6,10-11,15,18-19,21H2,1-3H3;1-2H2