ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxidanylidene-3-(1-pyridin-2-ylethylamino)prop-1-enyl]pyrrole-3-carboxylate

Systemtic Name: ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxidanylidene-3-(1-pyridin-2-ylethylamino)prop-1-enyl]pyrrole-3-carboxylate Openeye Name: ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxo-3-[1-(2-pyridyl)ethylamino]prop-1-enyl]pyrrole-3-carboxylate CAS Name: 1-ethyl-2,5-dimethyl-4-[(E)-3-oxo-3-[1-(2-pyridinyl)ethylamino]prop-1-enyl]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2,5-dimethyl-4-[(E)-3-oxo-3-(1-pyridin-2-ylethylamino)prop-1-enyl]pyrrole-3-carboxylate Traditional Name: 1-ethyl-4-[(E)-3-keto-3-[1-(2-pyridyl)ethylamino]prop-1-enyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)C(=O)OCC)C=CC(=O)NC(C)C2=CC=CC=N2)C

Isomeric SMILES

CCN1C(=C(C(=C1C)C(=O)OCC)/C=C/C(=O)NC(C)C2=CC=CC=N2)C

InChI

InChI=1S/C21H27N3O3/c1-6-24-15(4)17(20(16(24)5)21(26)27-7-2)11-12-19(25)23-14(3)18-10-8-9-13-22-18/h8-14H,6-7H2,1-5H3,(H,23,25)/b12-11+