5-chloranyl-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-1,3-dimethylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-1,3-dimethyl-pyrazole-4-carboxamide Formula: C18H22ClN3O3 MolecularWeight: 363.83858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNC(=O)C3=C(N(N=C3C)C)Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CNC(=O)C3=C(N(N=C3C)C)Cl

InChI

InChI=1S/C18H22ClN3O3/c1-5-24-14-7-12-6-10(2)25-15(12)8-13(14)9-20-18(23)16-11(3)21-22(4)17(16)19/h7-8,10H,5-6,9H2,1-4H3,(H,20,23)/t10-/m0/s1