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

Systemtic Name: dimethyl 5-[(2-pyrrolidin-1-ylpyridin-3-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 5-[(2-pyrrolidin-1-ylpyridine-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(2-pyrrolidinonicotinoyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)N3CCCC3)C(=O)OC

InChI

InChI=1S/C20H21N3O5/c1-27-19(25)13-10-14(20(26)28-2)12-15(11-13)22-18(24)16-6-5-7-21-17(16)23-8-3-4-9-23/h5-7,10-12H,3-4,8-9H2,1-2H3,(H,22,24)