methyl 2-(4-acetyloxyphenoxy)-5-[methyl-[3-(4-octadecoxyphenyl)propanoyl]amino]benzoate

Systemtic Name: methyl 2-(4-acetyloxyphenoxy)-5-[methyl-[3-(4-octadecoxyphenyl)propanoyl]amino]benzoate Openeye Name: methyl 2-(4-acetoxyphenoxy)-5-[methyl-[3-(4-octadecoxyphenyl)propanoyl]amino]benzoate CAS Name: 2-(4-acetyloxyphenoxy)-5-[methyl-[3-(4-octadecoxyphenyl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-(4-acetyloxyphenoxy)-5-[methyl-[3-(4-octadecoxyphenyl)propanoyl]amino]benzoate Traditional Name: 2-(4-acetoxyphenoxy)-5-[methyl-[3-(4-stearyloxyphenyl)propanoyl]amino]benzoic acid methyl ester Formula: C44H61NO7 MolecularWeight: 715.95764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)CCC(=O)N(C)C2=CC(=C(C=C2)OC3=CC=C(C=C3)OC(=O)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=C(C=C1)CCC(=O)N(C)C2=CC(=C(C=C2)OC3=CC=C(C=C3)OC(=O)C)C(=O)OC

InChI

InChI=1S/C44H61NO7/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-33-50-38-25-21-36(22-26-38)23-32-43(47)45(3)37-24-31-42(41(34-37)44(48)49-4)52-40-29-27-39(28-30-40)51-35(2)46/h21-22,24-31,34H,5-20,23,32-33H2,1-4H3