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

Systemtic Name: 4-chloranyl-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-methylsulfonyl-benzamide Openeye Name: 4-chloro-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-3-methylsulfonyl-benzamide CAS Name: 4-chloro-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methyl]-3-methylsulfonylbenzamide IUPAC Name: 4-chloro-N-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methyl]-3-methylsulfonylbenzamide Traditional Name: 4-chloro-N-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methyl]-3-mesyl-benzamide Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClNO5S/c1-4-26-17-8-14-7-12(2)27-18(14)9-15(17)11-22-20(23)13-5-6-16(21)19(10-13)28(3,24)25/h5-6,8-10,12H,4,7,11H2,1-3H3,(H,22,23)/t12-/m0/s1