(4-ethoxy-4-oxidanylidene-butan-2-yl) 4-(pentadecylamino)benzoate

Systemtic Name: (4-ethoxy-4-oxidanylidene-butan-2-yl) 4-(pentadecylamino)benzoate Openeye Name: (3-ethoxy-1-methyl-3-oxo-propyl) 4-(pentadecylamino)benzoate CAS Name: 4-(pentadecylamino)benzoic acid (4-ethoxy-4-oxobutan-2-yl) ester IUPAC Name: (4-ethoxy-4-oxobutan-2-yl) 4-(pentadecylamino)benzoate Traditional Name: 4-(pentadecylamino)benzoic acid (3-ethoxy-3-keto-1-methyl-propyl) ester Formula: C28H47NO4 MolecularWeight: 461.67708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(C)CC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OC(C)CC(=O)OCC

InChI

InChI=1S/C28H47NO4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-22-29-26-20-18-25(19-21-26)28(31)33-24(3)23-27(30)32-5-2/h18-21,24,29H,4-17,22-23H2,1-3H3