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4-(2-decan-4-yloxyphenyl)-3-methoxy-2-phenyl-benzoic acid

4-(2-decan-4-yloxyphenyl)-3-methoxy-2-phenyl-benzoic acid

Systemtic Name:4-(2-decan-4-yloxyphenyl)-3-methoxy-2-phenyl-benzoic acid
Openeye Name:3-methoxy-2-phenyl-4-[2-(1-propylheptoxy)phenyl]benzoic acid
CAS Name:4-(2-decan-4-yloxyphenyl)-3-methoxy-2-phenylbenzoic acid
IUPAC Name:4-(2-decan-4-yloxyphenyl)-3-methoxy-2-phenylbenzoic acid
Traditional Name:3-methoxy-2-phenyl-4-[2-(1-propylheptoxy)phenyl]benzoic acid
Formula: C30H36O4
MolecularWeight: 460.60444
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC)OC1=CC=CC=C1C2=C(C(=C(C=C2)C(=O)O)C3=CC=CC=C3)OC


Isomeric SMILES

CCCCCCC(CCC)OC1=CC=CC=C1C2=C(C(=C(C=C2)C(=O)O)C3=CC=CC=C3)OC


InChI

InChI=1S/C30H36O4/c1-4-6-7-11-17-23(14-5-2)34-27-19-13-12-18-24(27)25-20-21-26(30(31)32)28(29(25)33-3)22-15-9-8-10-16-22/h8-10,12-13,15-16,18-21,23H,4-7,11,14,17H2,1-3H3,(H,31,32)


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