propan-2-yl 2,4-dimethyl-5-(pyridin-3-ylmethylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-(pyridin-3-ylmethylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-(3-pyridylmethylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(3-pyridinylmethylamino)methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-(pyridin-3-ylmethylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(3-pyridylmethylcarbamoyl)-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCC2=CN=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C17H21N3O3/c1-10(2)23-17(22)14-11(3)15(20-12(14)4)16(21)19-9-13-6-5-7-18-8-13/h5-8,10,20H,9H2,1-4H3,(H,19,21)