1-[3-chloranyl-4-[2-methyl-4-(1-oxidanyloctadecyl)phenoxy]phenyl]-2,2-dimethyl-propan-1-one

Systemtic Name: 1-[3-chloranyl-4-[2-methyl-4-(1-oxidanyloctadecyl)phenoxy]phenyl]-2,2-dimethyl-propan-1-one Openeye Name: 1-[3-chloro-4-[4-(1-hydroxyoctadecyl)-2-methyl-phenoxy]phenyl]-2,2-dimethyl-propan-1-one CAS Name: 1-[3-chloro-4-[4-(1-hydroxyoctadecyl)-2-methylphenoxy]phenyl]-2,2-dimethyl-1-propanone IUPAC Name: 1-[3-chloro-4-[4-(1-hydroxyoctadecyl)-2-methylphenoxy]phenyl]-2,2-dimethylpropan-1-one Traditional Name: 1-[3-chloro-4-[4-(1-hydroxyoctadecyl)-2-methyl-phenoxy]phenyl]-2,2-dimethyl-propan-1-one Formula: C36H55ClO3 MolecularWeight: 571.2731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C(=O)C(C)(C)C)Cl)C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C(=O)C(C)(C)C)Cl)C)O

InChI

InChI=1S/C36H55ClO3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(38)29-22-24-33(28(2)26-29)40-34-25-23-30(27-31(34)37)35(39)36(3,4)5/h22-27,32,38H,6-21H2,1-5H3