ethyl 2,4-dimethyl-1-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-1-[2-oxidanylidene-2-(pyridin-3-ylmethylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-1-[2-oxo-2-(3-pyridylmethylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-1-[2-oxo-2-(3-pyridinylmethylamino)ethyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-1-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(3-pyridylmethylamino)ethyl]-2,4-dimethyl-5-phenyl-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(=C1C)C2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)NCC3=CN=CC=C3)C

InChI

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