ethyl 3,5-dimethyl-4-octyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-octyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-octyl-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-octyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-octyl-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-octyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H29NO2 MolecularWeight: 279.41766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(NC(=C1C)C(=O)OCC)C

Isomeric SMILES

CCCCCCCCC1=C(NC(=C1C)C(=O)OCC)C

InChI

InChI=1S/C17H29NO2/c1-5-7-8-9-10-11-12-15-13(3)16(18-14(15)4)17(19)20-6-2/h18H,5-12H2,1-4H3