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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC2=C(C=CC(=C2)OC)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC2=C(C=CC(=C2)OC)CNC(=O)CCC(=O)[O-]

InChI

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