4-[2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[4-(4-tert-amylphenoxy)phenyl]ethylamino]-4-keto-butyrate Formula: C23H28NO4- MolecularWeight: 382.47272

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)CCNC(=O)CCC(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)CCNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C23H29NO4/c1-4-23(2,3)18-7-11-20(12-8-18)28-19-9-5-17(6-10-19)15-16-24-21(25)13-14-22(26)27/h5-12H,4,13-16H2,1-3H3,(H,24,25)(H,26,27)/p-1