methyl 16-[4-(4-methylphenyl)carbonylphenyl]hexadecanoate

Systemtic Name: methyl 16-[4-(4-methylphenyl)carbonylphenyl]hexadecanoate Openeye Name: methyl 16-[4-(4-methylbenzoyl)phenyl]hexadecanoate CAS Name: 16-[4-[(4-methylphenyl)-oxomethyl]phenyl]hexadecanoic acid methyl ester IUPAC Name: methyl 16-[4-(4-methylbenzoyl)phenyl]hexadecanoate Traditional Name: 16-(4-p-toluoylphenyl)palmitic acid methyl ester Formula: C31H44O3 MolecularWeight: 464.67926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CCCCCCCCCCCCCCCC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CCCCCCCCCCCCCCCC(=O)OC

InChI

InChI=1S/C31H44O3/c1-26-18-22-28(23-19-26)31(33)29-24-20-27(21-25-29)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-30(32)34-2/h18-25H,3-17H2,1-2H3