propan-2-yl 2,4-dimethyl-5-(2-quinolin-8-ylethylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-(2-quinolin-8-ylethylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-[2-(8-quinolyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[2-(8-quinolinyl)ethylamino]methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-(2-quinolin-8-ylethylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(8-quinolyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCCC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCCC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C22H25N3O3/c1-13(2)28-22(27)18-14(3)19(25-15(18)4)21(26)24-12-10-17-8-5-7-16-9-6-11-23-20(16)17/h5-9,11,13,25H,10,12H2,1-4H3,(H,24,26)