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

Systemtic Name: (2-ethoxy-3-hexadecoxy-propyl) 2-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate Openeye Name: (2-ethoxy-3-hexadecoxy-propyl) 2-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate CAS Name: 2-[(3-methyl-2H-imidazol-1-yl)methyl]benzoic acid (2-ethoxy-3-hexadecoxypropyl) ester IUPAC Name: (2-ethoxy-3-hexadecoxypropyl) 2-[(3-methyl-2H-imidazol-1-yl)methyl]benzoate Traditional Name: 2-[(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=CC=C1CN2CN(C=C2)C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COC(=O)C1=CC=CC=C1CN2CN(C=C2)C)OCC

InChI

InChI=1S/C33H56N2O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-25-37-27-31(38-5-2)28-39-33(36)32-22-19-18-21-30(32)26-35-24-23-34(3)29-35/h18-19,21-24,31H,4-17,20,25-29H2,1-3H3