5-[[4-(4-tert-butylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[4-(4-tert-butylphenoxy)phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(4-tert-butylphenoxy)anilino]-5-oxo-pentanoic acid CAS Name: 5-[4-(4-tert-butylphenoxy)anilino]-5-oxopentanoic acid IUPAC Name: 5-[4-(4-tert-butylphenoxy)anilino]-5-oxopentanoic acid Traditional Name: 5-[4-(4-tert-butylphenoxy)anilino]-5-keto-valeric acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCC(=O)O

InChI

InChI=1S/C21H25NO4/c1-21(2,3)15-7-11-17(12-8-15)26-18-13-9-16(10-14-18)22-19(23)5-4-6-20(24)25/h7-14H,4-6H2,1-3H3,(H,22,23)(H,24,25)