ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxidanylidene-2-(pyridin-3-ylamino)ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxidanylidene-2-(pyridin-3-ylamino)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxo-2-(3-pyridylamino)acetyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[1,2-dioxo-2-(3-pyridinylamino)ethyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-oxo-2-(pyridin-3-ylamino)acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-keto-2-(3-pyridylamino)acetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)OC)C(=O)C(=O)NC3=CN=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)OC)C(=O)C(=O)NC3=CN=CC=C3)C

InChI

InChI=1S/C22H21N3O5/c1-4-30-22(28)17-13(2)24-19(18(17)14-7-9-16(29-3)10-8-14)20(26)21(27)25-15-6-5-11-23-12-15/h5-12,24H,4H2,1-3H3,(H,25,27)