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

Systemtic Name: 4-[2-[3-methoxy-2-(3-phenylpropoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[3-methoxy-2-(3-phenylpropoxy)phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[3-methoxy-2-(3-phenylpropoxy)phenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[3-methoxy-2-(3-phenylpropoxy)phenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-[3-methoxy-2-(3-phenylpropoxy)phenyl]ethylamino]butyric acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCCCC2=CC=CC=C2)CCNC(=O)CCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1OCCCC2=CC=CC=C2)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C22H27NO5/c1-27-19-11-5-10-18(14-15-23-20(24)12-13-21(25)26)22(19)28-16-6-9-17-7-3-2-4-8-17/h2-5,7-8,10-11H,6,9,12-16H2,1H3,(H,23,24)(H,25,26)