ethyl 3,5-dimethyl-4-[2-[3-methylbutanoyl(oxolan-2-ylmethyl)amino]ethanoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[2-[3-methylbutanoyl(oxolan-2-ylmethyl)amino]ethanoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[2-[3-methylbutanoyl(tetrahydrofuran-2-ylmethyl)amino]acetyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[2-[(3-methyl-1-oxobutyl)-(2-oxolanylmethyl)amino]-1-oxoethyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[2-[3-methylbutanoyl(oxolan-2-ylmethyl)amino]acetyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[isovaleryl(tetrahydrofurfuryl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN(CC2CCCO2)C(=O)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN(CC2CCCO2)C(=O)CC(C)C)C

InChI

InChI=1S/C21H32N2O5/c1-6-27-21(26)20-14(4)19(15(5)22-20)17(24)12-23(18(25)10-13(2)3)11-16-8-7-9-28-16/h13,16,22H,6-12H2,1-5H3