methyl 8-oxidanylidene-8-[(4-phenylmethoxyphenyl)amino]octanoate

Systemtic Name: methyl 8-oxidanylidene-8-[(4-phenylmethoxyphenyl)amino]octanoate Openeye Name: methyl 8-(4-benzyloxyanilino)-8-oxo-octanoate CAS Name: 8-oxo-8-(4-phenylmethoxyanilino)octanoic acid methyl ester IUPAC Name: methyl 8-oxo-8-(4-phenylmethoxyanilino)octanoate Traditional Name: 8-(4-benzoxyanilino)-8-keto-caprylic acid methyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCCCCC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C22H27NO4/c1-26-22(25)12-8-3-2-7-11-21(24)23-19-13-15-20(16-14-19)27-17-18-9-5-4-6-10-18/h4-6,9-10,13-16H,2-3,7-8,11-12,17H2,1H3,(H,23,24)