2-[3-[[methylsulfonyl-[(5-phenylfuran-2-yl)methyl]amino]methyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[[methylsulfonyl-[(5-phenylfuran-2-yl)methyl]amino]methyl]phenyl]ethanoic acid Openeye Name: 2-[3-[[methylsulfonyl-[(5-phenyl-2-furyl)methyl]amino]methyl]phenyl]acetic acid CAS Name: 2-[3-[[methylsulfonyl-[(5-phenyl-2-furanyl)methyl]amino]methyl]phenyl]acetic acid IUPAC Name: 2-[3-[[methylsulfonyl-[(5-phenylfuran-2-yl)methyl]amino]methyl]phenyl]acetic acid Traditional Name: 2-[3-[[mesyl-[(5-phenyl-2-furyl)methyl]amino]methyl]phenyl]acetic acid Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=CC(=C1)CC(=O)O)CC2=CC=C(O2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CC(=C1)CC(=O)O)CC2=CC=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO5S/c1-28(25,26)22(14-17-7-5-6-16(12-17)13-21(23)24)15-19-10-11-20(27-19)18-8-3-2-4-9-18/h2-12H,13-15H2,1H3,(H,23,24)