2-[3-[4-oxidanylidene-4-[phenyl-(phenylmethyl)amino]butyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[4-oxidanylidene-4-[phenyl-(phenylmethyl)amino]butyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[4-(N-benzylanilino)-4-oxo-butyl]phenoxy]acetic acid CAS Name: 2-[3-[4-oxo-4-(N-(phenylmethyl)anilino)butyl]phenoxy]acetic acid IUPAC Name: 2-[3-[4-(N-benzylanilino)-4-oxobutyl]phenoxy]acetic acid Traditional Name: 2-[3-[4-(N-benzylanilino)-4-keto-butyl]phenoxy]acetic acid Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CCCC3=CC(=CC=C3)OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)CCCC3=CC(=CC=C3)OCC(=O)O

InChI

InChI=1S/C25H25NO4/c27-24(16-8-12-20-11-7-15-23(17-20)30-19-25(28)29)26(22-13-5-2-6-14-22)18-21-9-3-1-4-10-21/h1-7,9-11,13-15,17H,8,12,16,18-19H2,(H,28,29)