3-phenylpropyl 5-oxidanylidene-5-[(4-phenethyloxyphenyl)amino]pentanoate

Systemtic Name: 3-phenylpropyl 5-oxidanylidene-5-[(4-phenethyloxyphenyl)amino]pentanoate Openeye Name: 3-phenylpropyl 5-oxo-5-(4-phenethyloxyanilino)pentanoate CAS Name: 5-oxo-5-(4-phenethyloxyanilino)pentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-oxo-5-(4-phenethyloxyanilino)pentanoate Traditional Name: 5-keto-5-(4-phenethyloxyanilino)valeric acid 3-phenylpropyl ester Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)OCCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)OCCC3=CC=CC=C3

InChI

InChI=1S/C28H31NO4/c30-27(14-7-15-28(31)33-21-8-13-23-9-3-1-4-10-23)29-25-16-18-26(19-17-25)32-22-20-24-11-5-2-6-12-24/h1-6,9-12,16-19H,7-8,13-15,20-22H2,(H,29,30)