(2S)-N-[[(2R)-5-chloranyl-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-butanamide

Systemtic Name: (2S)-N-[[(2R)-5-chloranyl-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methyl-butanamide Openeye Name: (2S)-N-[[(2R)-5-chloro-7-(4-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-methyl-butanamide CAS Name: (2S)-N-[[(2R)-5-chloro-7-pyridin-4-yl-2,3-dihydrobenzofuran-2-yl]methyl]-2-methylbutanamide IUPAC Name: (2S)-N-[[(2R)-5-chloro-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylbutanamide Traditional Name: (2S)-N-[[(2R)-5-chloro-7-(4-pyridyl)coumaran-2-yl]methyl]-2-methyl-butyramide Formula: C19H21ClN2O2 MolecularWeight: 344.83524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1CC2=C(O1)C(=CC(=C2)Cl)C3=CC=NC=C3

Isomeric SMILES

CC[C@H](C)C(=O)NC[C@H]1CC2=C(O1)C(=CC(=C2)Cl)C3=CC=NC=C3

InChI

InChI=1S/C19H21ClN2O2/c1-3-12(2)19(23)22-11-16-9-14-8-15(20)10-17(18(14)24-16)13-4-6-21-7-5-13/h4-8,10,12,16H,3,9,11H2,1-2H3,(H,22,23)/t12-,16+/m0/s1