methyl 2,4-dimethyl-5-(1-pyridin-4-ylethylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-(1-pyridin-4-ylethylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[1-(4-pyridyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(1-pyridin-4-ylethylamino)methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-(1-pyridin-4-ylethylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[1-(4-pyridyl)ethylcarbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O3/c1-9-13(16(21)22-4)11(3)18-14(9)15(20)19-10(2)12-5-7-17-8-6-12/h5-8,10,18H,1-4H3,(H,19,20)