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

Systemtic Name: methyl 2,4-dimethyl-5-(pyridin-4-ylmethylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-(4-pyridylmethylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(pyridin-4-ylmethylamino)methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-(pyridin-4-ylmethylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(4-pyridylmethylcarbamoyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O3/c1-9-12(15(20)21-3)10(2)18-13(9)14(19)17-8-11-4-6-16-7-5-11/h4-7,18H,8H2,1-3H3,(H,17,19)