12-[2-[4-(cyclohexyloxymethyl)phenyl]pyrimidin-5-yl]oxydodecyl prop-2-enoate

Systemtic Name: 12-[2-[4-(cyclohexyloxymethyl)phenyl]pyrimidin-5-yl]oxydodecyl prop-2-enoate Openeye Name: 12-[2-[4-(cyclohexoxymethyl)phenyl]pyrimidin-5-yl]oxydodecyl prop-2-enoate CAS Name: 2-propenoic acid 12-[[2-[4-(cyclohexyloxymethyl)phenyl]-5-pyrimidinyl]oxy]dodecyl ester IUPAC Name: 12-[2-[4-(cyclohexyloxymethyl)phenyl]pyrimidin-5-yl]oxydodecyl prop-2-enoate Traditional Name: acrylic acid 12-[2-[4-(cyclohexoxymethyl)phenyl]pyrimidin-5-yl]oxydodecyl ester Formula: C32H46N2O4 MolecularWeight: 522.71864

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)COC3CCCCC3

Isomeric SMILES

C=CC(=O)OCCCCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)COC3CCCCC3

InChI

InChI=1S/C32H46N2O4/c1-2-31(35)37-23-15-10-8-6-4-3-5-7-9-14-22-36-30-24-33-32(34-25-30)28-20-18-27(19-21-28)26-38-29-16-12-11-13-17-29/h2,18-21,24-25,29H,1,3-17,22-23,26H2