diethyl 5-[(2-pyrrolidin-1-ylpyridin-3-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[(2-pyrrolidin-1-ylpyridin-3-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(2-pyrrolidin-1-ylpyridine-3-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[2-(1-pyrrolidinyl)-3-pyridinyl]methyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(2-pyrrolidin-1-ylpyridine-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-pyrrolidinonicotinoyl)amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3)C(=O)OCC

InChI

InChI=1S/C22H25N3O5/c1-3-29-21(27)15-12-16(22(28)30-4-2)14-17(13-15)24-20(26)18-8-7-9-23-19(18)25-10-5-6-11-25/h7-9,12-14H,3-6,10-11H2,1-2H3,(H,24,26)