dimethyl 5-[[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(2R)-1-quinazolin-4-ylpyrrolidin-2-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(2R)-1-quinazolin-4-ylpyrrolidine-2-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[(2R)-1-(4-quinazolinyl)-2-pyrrolidinyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(2R)-1-quinazolin-4-ylpyrrolidine-2-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(2R)-1-quinazolin-4-ylprolyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCCN2C3=NC=NC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)[C@H]2CCCN2C3=NC=NC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C23H22N4O5/c1-31-22(29)14-10-15(23(30)32-2)12-16(11-14)26-21(28)19-8-5-9-27(19)20-17-6-3-4-7-18(17)24-13-25-20/h3-4,6-7,10-13,19H,5,8-9H2,1-2H3,(H,26,28)/t19-/m1/s1