ethyl 5-[[cyclohexyl(3-methylbutanoyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[[cyclohexyl(3-methylbutanoyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[[cyclohexyl(3-methylbutanoyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[cyclohexyl-(3-methyl-1-oxobutyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[cyclohexyl(3-methylbutanoyl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[[cyclohexyl(isovaleryl)amino]methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H34N2O3 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)CN(C2CCCCC2)C(=O)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)CN(C2CCCCC2)C(=O)CC(C)C)C

InChI

InChI=1S/C21H34N2O3/c1-6-26-21(25)20-15(4)18(22-16(20)5)13-23(19(24)12-14(2)3)17-10-8-7-9-11-17/h14,17,22H,6-13H2,1-5H3