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

Systemtic Name: 4-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylamino]-4-oxo-butanoate CAS Name: 4-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylamino]-4-oxobutanoate IUPAC Name: 4-[[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[[3-methoxy-4-(2-phenoxyethoxy)benzyl]amino]butyrate Formula: C20H22NO6- MolecularWeight: 372.39178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CCC(=O)[O-])OCCOC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CCC(=O)[O-])OCCOC2=CC=CC=C2

InChI

InChI=1S/C20H23NO6/c1-25-18-13-15(14-21-19(22)9-10-20(23)24)7-8-17(18)27-12-11-26-16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H,21,22)(H,23,24)/p-1