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12-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]dodecanoic acid

12-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]dodecanoic acid

Systemtic Name:12-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]dodecanoic acid
Openeye Name:12-[3-(4-chlorobenzoyl)-2-methyl-phenyl]dodecanoic acid
CAS Name:12-[3-[(4-chlorophenyl)-oxomethyl]-2-methylphenyl]dodecanoic acid
IUPAC Name:12-[3-(4-chlorobenzoyl)-2-methylphenyl]dodecanoic acid
Traditional Name:12-[3-(4-chlorobenzoyl)-2-methyl-phenyl]lauric acid
Formula: C26H33ClO3
MolecularWeight: 428.99142
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1CCCCCCCCCCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl


Isomeric SMILES

CC1=C(C=CC=C1CCCCCCCCCCCC(=O)O)C(=O)C2=CC=C(C=C2)Cl


InChI

InChI=1S/C26H33ClO3/c1-20-21(12-9-7-5-3-2-4-6-8-10-15-25(28)29)13-11-14-24(20)26(30)22-16-18-23(27)19-17-22/h11,13-14,16-19H,2-10,12,15H2,1H3,(H,28,29)


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