4-oxidanylidene-4-[2-[4-(2-propan-2-ylphenoxy)phenyl]ethylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[2-[4-(2-propan-2-ylphenoxy)phenyl]ethylamino]butanoic acid Openeye Name: 4-[2-[4-(2-isopropylphenoxy)phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[2-[4-(2-propan-2-ylphenoxy)phenyl]ethylamino]butanoic acid IUPAC Name: 4-oxo-4-[2-[4-(2-propan-2-ylphenoxy)phenyl]ethylamino]butanoic acid Traditional Name: 4-[2-[4-(2-isopropylphenoxy)phenyl]ethylamino]-4-keto-butyric acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC2=CC=C(C=C2)CCNC(=O)CCC(=O)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=CC=C(C=C2)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C21H25NO4/c1-15(2)18-5-3-4-6-19(18)26-17-9-7-16(8-10-17)13-14-22-20(23)11-12-21(24)25/h3-10,15H,11-14H2,1-2H3,(H,22,23)(H,24,25)