ethyl 1-ethyl-4-[2-(3-ethylphenoxy)ethanoyl]-3,5-dimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 1-ethyl-4-[2-(3-ethylphenoxy)ethanoyl]-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 1-ethyl-4-[2-(3-ethylphenoxy)acetyl]-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 1-ethyl-4-[2-(3-ethylphenoxy)-1-oxoethyl]-3,5-dimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-[2-(3-ethylphenoxy)acetyl]-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 1-ethyl-4-[2-(3-ethylphenoxy)acetyl]-3,5-dimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(=O)C2=C(N(C(=C2C)C(=O)OCC)CC)C

Isomeric SMILES

CCC1=CC(=CC=C1)OCC(=O)C2=C(N(C(=C2C)C(=O)OCC)CC)C

InChI

InChI=1S/C21H27NO4/c1-6-16-10-9-11-17(12-16)26-13-18(23)19-14(4)20(21(24)25-8-3)22(7-2)15(19)5/h9-12H,6-8,13H2,1-5H3