4-[2-[[1-[(4-dodecylphenyl)amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanyl-phenoxy]benzoic acid

Systemtic Name: 4-[2-[[1-[(4-dodecylphenyl)amino]-1-oxidanylidene-propan-2-yl]amino]-4-oxidanyl-phenoxy]benzoic acid Openeye Name: 4-[2-[[2-(4-dodecylanilino)-1-methyl-2-oxo-ethyl]amino]-4-hydroxy-phenoxy]benzoic acid CAS Name: 4-[2-[[1-(4-dodecylanilino)-1-oxopropan-2-yl]amino]-4-hydroxyphenoxy]benzoic acid IUPAC Name: 4-[2-[[1-(4-dodecylanilino)-1-oxopropan-2-yl]amino]-4-hydroxyphenoxy]benzoic acid Traditional Name: 4-[4-hydroxy-2-[[2-keto-2-(4-laurylanilino)-1-methyl-ethyl]amino]phenoxy]benzoic acid Formula: C34H44N2O5 MolecularWeight: 560.72356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)C(C)NC2=C(C=CC(=C2)O)OC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)NC(=O)C(C)NC2=C(C=CC(=C2)O)OC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C34H44N2O5/c1-3-4-5-6-7-8-9-10-11-12-13-26-14-18-28(19-15-26)36-33(38)25(2)35-31-24-29(37)20-23-32(31)41-30-21-16-27(17-22-30)34(39)40/h14-25,35,37H,3-13H2,1-2H3,(H,36,38)(H,39,40)