[2-methyl-1-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]propyl]phosphonic acid

Systemtic Name: [2-methyl-1-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]propyl]phosphonic acid Openeye Name: [2-methyl-1-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]propyl]phosphonic acid CAS Name: [2-methyl-1-[[4-[4-(1-pyrrolidinyl)phenyl]phenyl]sulfonylamino]propyl]phosphonic acid IUPAC Name: [2-methyl-1-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]propyl]phosphonic acid Traditional Name: [2-methyl-1-[[4-(4-pyrrolidinophenyl)phenyl]sulfonylamino]propyl]phosphonic acid Formula: C20H27N2O5PS MolecularWeight: 438.477541

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)N3CCCC3)P(=O)(O)O

Isomeric SMILES

CC(C)C(NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)N3CCCC3)P(=O)(O)O

InChI

InChI=1S/C20H27N2O5PS/c1-15(2)20(28(23,24)25)21-29(26,27)19-11-7-17(8-12-19)16-5-9-18(10-6-16)22-13-3-4-14-22/h5-12,15,20-21H,3-4,13-14H2,1-2H3,(H2,23,24,25)