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

Systemtic Name: 3-phenylpropyl 5-oxidanylidene-5-[(4-phenoxyphenyl)amino]pentanoate Openeye Name: 3-phenylpropyl 5-oxo-5-(4-phenoxyanilino)pentanoate CAS Name: 5-oxo-5-(4-phenoxyanilino)pentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-oxo-5-(4-phenoxyanilino)pentanoate Traditional Name: 5-keto-5-(4-phenoxyanilino)valeric acid 3-phenylpropyl ester Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H27NO4/c28-25(14-7-15-26(29)30-20-8-11-21-9-3-1-4-10-21)27-22-16-18-24(19-17-22)31-23-12-5-2-6-13-23/h1-6,9-10,12-13,16-19H,7-8,11,14-15,20H2,(H,27,28)