ethyl 5-(4-methoxyphenyl)-2-methyl-1-(pyridin-4-ylcarbonylamino)pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(4-methoxyphenyl)-2-methyl-1-(pyridin-4-ylcarbonylamino)pyrrole-3-carboxylate Openeye Name: ethyl 5-(4-methoxyphenyl)-2-methyl-1-(pyridine-4-carbonylamino)pyrrole-3-carboxylate CAS Name: 5-(4-methoxyphenyl)-2-methyl-1-[[oxo(pyridin-4-yl)methyl]amino]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methoxyphenyl)-2-methyl-1-(pyridine-4-carbonylamino)pyrrole-3-carboxylate Traditional Name: 1-isonicotinamido-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)OC)NC(=O)C3=CC=NC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)OC)NC(=O)C3=CC=NC=C3)C

InChI

InChI=1S/C21H21N3O4/c1-4-28-21(26)18-13-19(15-5-7-17(27-3)8-6-15)24(14(18)2)23-20(25)16-9-11-22-12-10-16/h5-13H,4H2,1-3H3,(H,23,25)