methyl 3-[4-[(2-methylpropan-2-yl)oxycarbonyl-octadecyl-amino]phenyl]propanoate

Systemtic Name: methyl 3-[4-[(2-methylpropan-2-yl)oxycarbonyl-octadecyl-amino]phenyl]propanoate Openeye Name: methyl 3-[4-[tert-butoxycarbonyl(octadecyl)amino]phenyl]propanoate CAS Name: 3-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]-octadecylamino]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(2-methylpropan-2-yl)oxycarbonyl-octadecylamino]phenyl]propanoate Traditional Name: 3-[4-[tert-butoxycarbonyl(stearyl)amino]phenyl]propionic acid methyl ester Formula: C33H57NO4 MolecularWeight: 531.80998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C1=CC=C(C=C1)CCC(=O)OC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C1=CC=C(C=C1)CCC(=O)OC)C(=O)OC(C)(C)C

InChI

InChI=1S/C33H57NO4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-28-34(32(36)38-33(2,3)4)30-25-22-29(23-26-30)24-27-31(35)37-5/h22-23,25-26H,6-21,24,27-28H2,1-5H3