ethyl 3,5-dimethyl-4-[3-oxidanylidene-3-(1-phenylethylamino)propyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[3-oxidanylidene-3-(1-phenylethylamino)propyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[3-oxo-3-(1-phenylethylamino)propyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[3-oxo-3-(1-phenylethylamino)propyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[3-oxo-3-(1-phenylethylamino)propyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[3-keto-3-(1-phenylethylamino)propyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)CCC(=O)NC(C)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)CCC(=O)NC(C)C2=CC=CC=C2)C

InChI

InChI=1S/C20H26N2O3/c1-5-25-20(24)19-13(2)17(15(4)22-19)11-12-18(23)21-14(3)16-9-7-6-8-10-16/h6-10,14,22H,5,11-12H2,1-4H3,(H,21,23)