ethyl 2-[[2,3-dihydro-1-benzofuran-5-ylcarbonyl-[(1,5-dimethylpyrazol-3-yl)methyl]amino]methyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl 2-[[2,3-dihydro-1-benzofuran-5-ylcarbonyl-[(1,5-dimethylpyrazol-3-yl)methyl]amino]methyl]cyclopropane-1-carboxylate Openeye Name: ethyl 2-[[2,3-dihydrobenzofuran-5-carbonyl-[(1,5-dimethylpyrazol-3-yl)methyl]amino]methyl]cyclopropanecarboxylate CAS Name: 2-[[[2,3-dihydrobenzofuran-5-yl(oxo)methyl]-[(1,5-dimethyl-3-pyrazolyl)methyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2,3-dihydro-1-benzofuran-5-carbonyl-[(1,5-dimethylpyrazol-3-yl)methyl]amino]methyl]cyclopropane-1-carboxylate Traditional Name: 2-[[coumaran-5-carbonyl-[(1,5-dimethylpyrazol-3-yl)methyl]amino]methyl]cyclopropanecarboxylic acid ethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1CN(CC2=NN(C(=C2)C)C)C(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CCOC(=O)C1CC1CN(CC2=NN(C(=C2)C)C)C(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C22H27N3O4/c1-4-28-22(27)19-11-17(19)12-25(13-18-9-14(2)24(3)23-18)21(26)16-5-6-20-15(10-16)7-8-29-20/h5-6,9-10,17,19H,4,7-8,11-13H2,1-3H3