4-[[3-[2-(2-ethoxyphenoxy)ethoxy]phenyl]methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[3-[2-(2-ethoxyphenoxy)ethoxy]phenyl]methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-[2-(2-ethoxyphenoxy)ethoxy]phenyl]methylamino]-4-oxo-butanoate CAS Name: 4-[[3-[2-(2-ethoxyphenoxy)ethoxy]phenyl]methylamino]-4-oxobutanoate IUPAC Name: 4-[[3-[2-(2-ethoxyphenoxy)ethoxy]phenyl]methylamino]-4-oxobutanoate Traditional Name: 4-[[3-[2-(2-ethoxyphenoxy)ethoxy]benzyl]amino]-4-keto-butyrate Formula: C21H24NO6- MolecularWeight: 386.41836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCOC2=CC=CC(=C2)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1OCCOC2=CC=CC(=C2)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C21H25NO6/c1-2-26-18-8-3-4-9-19(18)28-13-12-27-17-7-5-6-16(14-17)15-22-20(23)10-11-21(24)25/h3-9,14H,2,10-13,15H2,1H3,(H,22,23)(H,24,25)/p-1