(2-ethoxy-3-hexadecoxy-propyl) 4-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate

Systemtic Name: (2-ethoxy-3-hexadecoxy-propyl) 4-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate Openeye Name: (2-ethoxy-3-hexadecoxy-propyl) 4-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate CAS Name: 4-[(3-methyl-2H-imidazol-1-yl)methyl]benzoic acid (2-ethoxy-3-hexadecoxypropyl) ester IUPAC Name: (2-ethoxy-3-hexadecoxypropyl) 4-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate Traditional Name: 4-[(3-methyl-4-imidazolin-1-yl)methyl]benzoic acid (3-cetyloxy-2-ethoxy-propyl) ester Formula: C33H56N2O4 MolecularWeight: 544.80874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COC(=O)C1=CC=C(C=C1)CN2CN(C=C2)C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COC(=O)C1=CC=C(C=C1)CN2CN(C=C2)C)OCC

InChI

InChI=1S/C33H56N2O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-25-37-27-32(38-5-2)28-39-33(36)31-21-19-30(20-22-31)26-35-24-23-34(3)29-35/h19-24,32H,4-18,25-29H2,1-3H3