ethyl 1-[(3-methylphenyl)methyl]-3-(pyridin-3-ylcarbonylamino)pyrrole-2-carboxylate

Systemtic Name: ethyl 1-[(3-methylphenyl)methyl]-3-(pyridin-3-ylcarbonylamino)pyrrole-2-carboxylate Openeye Name: ethyl 1-(m-tolylmethyl)-3-(pyridine-3-carbonylamino)pyrrole-2-carboxylate CAS Name: 1-[(3-methylphenyl)methyl]-3-[[oxo(3-pyridinyl)methyl]amino]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(3-methylphenyl)methyl]-3-(pyridine-3-carbonylamino)pyrrole-2-carboxylate Traditional Name: 1-(3-methylbenzyl)-3-nicotinamido-pyrrole-2-carboxylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CN1CC2=CC=CC(=C2)C)NC(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C=CN1CC2=CC=CC(=C2)C)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H21N3O3/c1-3-27-21(26)19-18(23-20(25)17-8-5-10-22-13-17)9-11-24(19)14-16-7-4-6-15(2)12-16/h4-13H,3,14H2,1-2H3,(H,23,25)