4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-ethoxy-4-(m-tolylmethoxy)phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-ethoxy-4-(3-methylbenzyl)oxy-benzyl]amino]-4-keto-butyric acid Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC(=O)CCC(=O)O)OCC2=CC=CC(=C2)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC(=O)CCC(=O)O)OCC2=CC=CC(=C2)C

InChI

InChI=1S/C21H25NO5/c1-3-26-19-12-16(13-22-20(23)9-10-21(24)25)7-8-18(19)27-14-17-6-4-5-15(2)11-17/h4-8,11-12H,3,9-10,13-14H2,1-2H3,(H,22,23)(H,24,25)