2-methoxy-3-[4-[2-(4-methylpentan-2-ylamino)-2-oxidanylidene-ethoxy]phenyl]propanoic acid

Systemtic Name: 2-methoxy-3-[4-[2-(4-methylpentan-2-ylamino)-2-oxidanylidene-ethoxy]phenyl]propanoic acid Openeye Name: 3-[4-[2-(1,3-dimethylbutylamino)-2-oxo-ethoxy]phenyl]-2-methoxy-propanoic acid CAS Name: 2-methoxy-3-[4-[2-(4-methylpentan-2-ylamino)-2-oxoethoxy]phenyl]propanoic acid IUPAC Name: 2-methoxy-3-[4-[2-(4-methylpentan-2-ylamino)-2-oxoethoxy]phenyl]propanoic acid Traditional Name: 3-[4-[2-(1,3-dimethylbutylamino)-2-keto-ethoxy]phenyl]-2-methoxy-propionic acid Formula: C18H27NO5 MolecularWeight: 337.41068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)NC(=O)COC1=CC=C(C=C1)CC(C(=O)O)OC

Isomeric SMILES

CC(C)CC(C)NC(=O)COC1=CC=C(C=C1)CC(C(=O)O)OC

InChI

InChI=1S/C18H27NO5/c1-12(2)9-13(3)19-17(20)11-24-15-7-5-14(6-8-15)10-16(23-4)18(21)22/h5-8,12-13,16H,9-11H2,1-4H3,(H,19,20)(H,21,22)