diethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-(1,3-benzoxazol-2-yl)-4-piperidinyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[1-(1,3-benzoxazol-2-yl)piperidine-4-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(1,3-benzoxazol-2-yl)isonipecotoyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C25H27N3O6 MolecularWeight: 465.49838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)C(=O)OCC

InChI

InChI=1S/C25H27N3O6/c1-3-32-23(30)17-13-18(24(31)33-4-2)15-19(14-17)26-22(29)16-9-11-28(12-10-16)25-27-20-7-5-6-8-21(20)34-25/h5-8,13-16H,3-4,9-12H2,1-2H3,(H,26,29)