methyl 3-[2-(oxan-4-ylcarbonylamino)pyridin-4-yl]-5-phenylazanyl-benzoate

Systemtic Name: methyl 3-[2-(oxan-4-ylcarbonylamino)pyridin-4-yl]-5-phenylazanyl-benzoate Openeye Name: methyl 3-anilino-5-[2-(tetrahydropyran-4-carbonylamino)-4-pyridyl]benzoate CAS Name: 3-anilino-5-[2-[[4-oxanyl(oxo)methyl]amino]-4-pyridinyl]benzoic acid methyl ester IUPAC Name: methyl 3-anilino-5-[2-(oxane-4-carbonylamino)pyridin-4-yl]benzoate Traditional Name: 3-anilino-5-[2-(tetrahydropyran-4-carbonylamino)-4-pyridyl]benzoic acid methyl ester Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C2=CC(=NC=C2)NC(=O)C3CCOCC3)NC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C2=CC(=NC=C2)NC(=O)C3CCOCC3)NC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4/c1-31-25(30)20-13-19(14-22(15-20)27-21-5-3-2-4-6-21)18-7-10-26-23(16-18)28-24(29)17-8-11-32-12-9-17/h2-7,10,13-17,27H,8-9,11-12H2,1H3,(H,26,28,29)