methyl 5-[2-azanyl-1-oxidanyl-2-oxidanylidene-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoate

Systemtic Name: methyl 5-[2-azanyl-1-oxidanyl-2-oxidanylidene-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoate Openeye Name: methyl 5-[2-amino-1-hydroxy-2-oxo-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoate CAS Name: 5-[2-amino-1-hydroxy-2-oxo-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoic acid methyl ester IUPAC Name: methyl 5-[2-amino-1-hydroxy-2-oxo-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoate Traditional Name: 5-[2-amino-1-hydroxy-2-keto-1-[4-(2-phenylphenoxy)phenyl]ethoxy]valeric acid methyl ester Formula: C26H27NO6 MolecularWeight: 449.49568

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCOC(C1=CC=C(C=C1)OC2=CC=CC=C2C3=CC=CC=C3)(C(=O)N)O

Isomeric SMILES

COC(=O)CCCCOC(C1=CC=C(C=C1)OC2=CC=CC=C2C3=CC=CC=C3)(C(=O)N)O

InChI

InChI=1S/C26H27NO6/c1-31-24(28)13-7-8-18-32-26(30,25(27)29)20-14-16-21(17-15-20)33-23-12-6-5-11-22(23)19-9-3-2-4-10-19/h2-6,9-12,14-17,30H,7-8,13,18H2,1H3,(H2,27,29)