[bis(fluoranyl)-[4-[(2S)-3-[[4-[(4-methoxyphenyl)amino]phenyl]amino]-3-oxidanylidene-2-(phenylsulfonylamino)propyl]phenyl]methyl]phosphonic acid

Systemtic Name: [bis(fluoranyl)-[4-[(2S)-3-[[4-[(4-methoxyphenyl)amino]phenyl]amino]-3-oxidanylidene-2-(phenylsulfonylamino)propyl]phenyl]methyl]phosphonic acid Openeye Name: [[4-[(2S)-2-(benzenesulfonamido)-3-[4-(4-methoxyanilino)anilino]-3-oxo-propyl]phenyl]-difluoro-methyl]phosphonic acid CAS Name: [[4-[(2S)-2-(benzenesulfonamido)-3-[4-(4-methoxyanilino)anilino]-3-oxopropyl]phenyl]-difluoromethyl]phosphonic acid IUPAC Name: [[4-[(2S)-2-(benzenesulfonamido)-3-[4-(4-methoxyanilino)anilino]-3-oxopropyl]phenyl]-difluoromethyl]phosphonic acid Traditional Name: [[4-[(2S)-2-(benzenesulfonamido)-3-keto-3-[4-(p-anisidino)anilino]propyl]phenyl]-difluoro-methyl]phosphonic acid Formula: C29H28F2N3O7PS MolecularWeight: 631.584087

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)C(CC3=CC=C(C=C3)C(F)(F)P(=O)(O)O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)[C@H](CC3=CC=C(C=C3)C(F)(F)P(=O)(O)O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H28F2N3O7PS/c1-41-25-17-15-23(16-18-25)32-22-11-13-24(14-12-22)33-28(35)27(34-43(39,40)26-5-3-2-4-6-26)19-20-7-9-21(10-8-20)29(30,31)42(36,37)38/h2-18,27,32,34H,19H2,1H3,(H,33,35)(H2,36,37,38)/t27-/m0/s1