1-[4-[[(2-phenoxypyridin-3-yl)carbonylamino]methyl]phenyl]cyclopropane-1-carboxylic acid

Systemtic Name: 1-[4-[[(2-phenoxypyridin-3-yl)carbonylamino]methyl]phenyl]cyclopropane-1-carboxylic acid Openeye Name: 1-[4-[[(2-phenoxypyridine-3-carbonyl)amino]methyl]phenyl]cyclopropanecarboxylic acid CAS Name: 1-[4-[[[oxo-(2-phenoxy-3-pyridinyl)methyl]amino]methyl]phenyl]-1-cyclopropanecarboxylic acid IUPAC Name: 1-[4-[[(2-phenoxypyridine-3-carbonyl)amino]methyl]phenyl]cyclopropane-1-carboxylic acid Traditional Name: 1-[4-[[(2-phenoxynicotinoyl)amino]methyl]phenyl]cyclopropanecarboxylic acid Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C2=CC=C(C=C2)CNC(=O)C3=C(N=CC=C3)OC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC1(C2=CC=C(C=C2)CNC(=O)C3=C(N=CC=C3)OC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H20N2O4/c26-20(19-7-4-14-24-21(19)29-18-5-2-1-3-6-18)25-15-16-8-10-17(11-9-16)23(12-13-23)22(27)28/h1-11,14H,12-13,15H2,(H,25,26)(H,27,28)