(2-ethoxy-2-oxidanylidene-ethyl) 4-(hexadecylamino)benzoate

Systemtic Name: (2-ethoxy-2-oxidanylidene-ethyl) 4-(hexadecylamino)benzoate Openeye Name: (2-ethoxy-2-oxo-ethyl) 4-(hexadecylamino)benzoate CAS Name: 4-(hexadecylamino)benzoic acid (2-ethoxy-2-oxoethyl) ester IUPAC Name: (2-ethoxy-2-oxoethyl) 4-(hexadecylamino)benzoate Traditional Name: 4-(cetylamino)benzoic acid (2-ethoxy-2-keto-ethyl) ester Formula: C27H45NO4 MolecularWeight: 447.6505

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OCC(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C(=O)OCC(=O)OCC

InChI

InChI=1S/C27H45NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-22-28-25-20-18-24(19-21-25)27(30)32-23-26(29)31-4-2/h18-21,28H,3-17,22-23H2,1-2H3