sodium 5-[2-azanyl-2-oxidanylidene-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoic acid

Systemtic Name: sodium 5-[2-azanyl-2-oxidanylidene-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoic acid Openeye Name: sodium 5-[2-amino-2-oxo-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoic acid CAS Name: sodium 5-[2-amino-2-oxo-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoic acid IUPAC Name: sodium 5-[2-amino-2-oxo-1-[4-(2-phenylphenoxy)phenyl]ethoxy]pentanoic acid Traditional Name: sodium 5-[2-amino-2-keto-1-[4-(2-phenylphenoxy)phenyl]ethoxy]valeric acid Formula: C25H25NNaO5+ MolecularWeight: 442.45947

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2OC3=CC=C(C=C3)C(C(=O)N)OCCCCC(=O)O.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2OC3=CC=C(C=C3)C(C(=O)N)OCCCCC(=O)O.[Na+]

InChI

InChI=1S/C25H25NO5.Na/c26-25(29)24(30-17-7-6-12-23(27)28)19-13-15-20(16-14-19)31-22-11-5-4-10-21(22)18-8-2-1-3-9-18;/h1-5,8-11,13-16,24H,6-7,12,17H2,(H2,26,29)(H,27,28);/q;+1