methyl 2-[2-[6-(4-cyclododecyloxyphenoxy)pyridin-3-yl]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[6-(4-cyclododecyloxyphenoxy)pyridin-3-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[6-[4-(cyclododecoxy)phenoxy]-3-pyridyl]acetyl]amino]benzoate CAS Name: 2-[[2-[6-(4-cyclododecyloxyphenoxy)-3-pyridinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[6-(4-cyclododecyloxyphenoxy)pyridin-3-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[6-[4-(cyclododecoxy)phenoxy]-3-pyridyl]acetyl]amino]benzoic acid methyl ester Formula: C33H40N2O5 MolecularWeight: 544.6811

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CC2=CN=C(C=C2)OC3=CC=C(C=C3)OC4CCCCCCCCCCC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CC2=CN=C(C=C2)OC3=CC=C(C=C3)OC4CCCCCCCCCCC4

InChI

InChI=1S/C33H40N2O5/c1-38-33(37)29-15-11-12-16-30(29)35-31(36)23-25-17-22-32(34-24-25)40-28-20-18-27(19-21-28)39-26-13-9-7-5-3-2-4-6-8-10-14-26/h11-12,15-22,24,26H,2-10,13-14,23H2,1H3,(H,35,36)