ethyl 4-[3-[4-(diethylamino)phenyl]-4-(3-oxidanylpropoxy)phenyl]benzoate

Systemtic Name: ethyl 4-[3-[4-(diethylamino)phenyl]-4-(3-oxidanylpropoxy)phenyl]benzoate Openeye Name: ethyl 4-[3-[4-(diethylamino)phenyl]-4-(3-hydroxypropoxy)phenyl]benzoate CAS Name: 4-[3-[4-(diethylamino)phenyl]-4-(3-hydroxypropoxy)phenyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[4-(diethylamino)phenyl]-4-(3-hydroxypropoxy)phenyl]benzoate Traditional Name: 4-[3-[4-(diethylamino)phenyl]-4-(3-hydroxypropoxy)phenyl]benzoic acid ethyl ester Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2=C(C=CC(=C2)C3=CC=C(C=C3)C(=O)OCC)OCCCO

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2=C(C=CC(=C2)C3=CC=C(C=C3)C(=O)OCC)OCCCO

InChI

InChI=1S/C28H33NO4/c1-4-29(5-2)25-15-12-22(13-16-25)26-20-24(14-17-27(26)33-19-7-18-30)21-8-10-23(11-9-21)28(31)32-6-3/h8-17,20,30H,4-7,18-19H2,1-3H3