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

Systemtic Name: ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-(1-oxooctyl)-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-octanoyl-1H-pyrrole-2-carboxylate Traditional Name: 4-caprylyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H27NO3 MolecularWeight: 293.40118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=C(NC(=C1C)C(=O)OCC)C

Isomeric SMILES

CCCCCCCC(=O)C1=C(NC(=C1C)C(=O)OCC)C

InChI

InChI=1S/C17H27NO3/c1-5-7-8-9-10-11-14(19)15-12(3)16(18-13(15)4)17(20)21-6-2/h18H,5-11H2,1-4H3