3-[2-(oxolan-3-ylcarbonylamino)pyridin-4-yl]-5-phenylazanyl-benzoic acid

Systemtic Name: 3-[2-(oxolan-3-ylcarbonylamino)pyridin-4-yl]-5-phenylazanyl-benzoic acid Openeye Name: 3-anilino-5-[2-(tetrahydrofuran-3-carbonylamino)-4-pyridyl]benzoic acid CAS Name: 3-anilino-5-[2-[[oxo(3-oxolanyl)methyl]amino]-4-pyridinyl]benzoic acid IUPAC Name: 3-anilino-5-[2-(oxolane-3-carbonylamino)pyridin-4-yl]benzoic acid Traditional Name: 3-anilino-5-[2-(tetrahydrofuran-3-carbonylamino)-4-pyridyl]benzoic acid Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(=O)NC2=NC=CC(=C2)C3=CC(=CC(=C3)NC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1COCC1C(=O)NC2=NC=CC(=C2)C3=CC(=CC(=C3)NC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C23H21N3O4/c27-22(16-7-9-30-14-16)26-21-13-15(6-8-24-21)17-10-18(23(28)29)12-20(11-17)25-19-4-2-1-3-5-19/h1-6,8,10-13,16,25H,7,9,14H2,(H,28,29)(H,24,26,27)