ethyl 2-methyl-5-(4-methylphenyl)-1-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-(4-methylphenyl)-1-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl]pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[2-oxo-2-(3-pyridylmethylamino)ethyl]-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2-methyl-5-(4-methylphenyl)-1-[2-oxo-2-(3-pyridinylmethylamino)ethyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-(4-methylphenyl)-1-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]pyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(3-pyridylmethylamino)ethyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CC(=O)NCC3=CN=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CC(=O)NCC3=CN=CC=C3)C

InChI

InChI=1S/C23H25N3O3/c1-4-29-23(28)20-12-21(19-9-7-16(2)8-10-19)26(17(20)3)15-22(27)25-14-18-6-5-11-24-13-18/h5-13H,4,14-15H2,1-3H3,(H,25,27)