[4-(dibutylamino)-3-oxidanyl-phenyl] benzoate

Systemtic Name: [4-(dibutylamino)-3-oxidanyl-phenyl] benzoate Openeye Name: [4-(dibutylamino)-3-hydroxy-phenyl] benzoate CAS Name: benzoic acid [4-(dibutylamino)-3-hydroxyphenyl] ester IUPAC Name: [4-(dibutylamino)-3-hydroxyphenyl] benzoate Traditional Name: benzoic acid [4-(dibutylamino)-3-hydroxy-phenyl] ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=C(C=C(C=C1)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCN(CCCC)C1=C(C=C(C=C1)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C21H27NO3/c1-3-5-14-22(15-6-4-2)19-13-12-18(16-20(19)23)25-21(24)17-10-8-7-9-11-17/h7-13,16,23H,3-6,14-15H2,1-2H3