ethyl 4-tridecyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-tridecyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-tridecyl-1H-pyrrole-2-carboxylate CAS Name: 4-tridecyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-tridecyl-1H-pyrrole-2-carboxylate Traditional Name: 4-tridecyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C20H35NO2 MolecularWeight: 321.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CNC(=C1)C(=O)OCC

Isomeric SMILES

CCCCCCCCCCCCCC1=CNC(=C1)C(=O)OCC

InChI

InChI=1S/C20H35NO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-18-16-19(21-17-18)20(22)23-4-2/h16-17,21H,3-15H2,1-2H3