4-[2-[3-methoxy-2-(2-phenoxyethoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[3-methoxy-2-(2-phenoxyethoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[3-methoxy-2-(2-phenoxyethoxy)phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[3-methoxy-2-(2-phenoxyethoxy)phenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[3-methoxy-2-(2-phenoxyethoxy)phenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-[3-methoxy-2-(2-phenoxyethoxy)phenyl]ethylamino]butyric acid Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCCOC2=CC=CC=C2)CCNC(=O)CCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OCCOC2=CC=CC=C2)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C21H25NO6/c1-26-18-9-5-6-16(12-13-22-19(23)10-11-20(24)25)21(18)28-15-14-27-17-7-3-2-4-8-17/h2-9H,10-15H2,1H3,(H,22,23)(H,24,25)