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

Systemtic Name: ethyl 3,5-dimethyl-4-[[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]methyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[[2-pyridylmethyl(tetrahydrofuran-2-ylmethyl)amino]methyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[[2-oxolanylmethyl(2-pyridinylmethyl)amino]methyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[[oxolan-2-ylmethyl(pyridin-2-ylmethyl)amino]methyl]-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[[2-pyridylmethyl(tetrahydrofurfuryl)amino]methyl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)CN(CC2CCCO2)CC3=CC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)CN(CC2CCCO2)CC3=CC=CC=N3)C

InChI

InChI=1S/C21H29N3O3/c1-4-26-21(25)20-15(2)19(16(3)23-20)14-24(13-18-9-7-11-27-18)12-17-8-5-6-10-22-17/h5-6,8,10,18,23H,4,7,9,11-14H2,1-3H3