(2R,3S)-2,3-dimethyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: (2R,3S)-2,3-dimethyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: (2R,3S)-2,3-dimethyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydrobenzofuran-7-carboxamide CAS Name: (2R,3S)-2,3-dimethyl-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: (2R,3S)-2,3-dimethyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: (2R,3S)-2,3-dimethyl-N-(3-pyrrolidinosulfonylphenyl)coumaran-7-carboxamide Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=CC=C12)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

C[C@@H]1[C@H](OC2=C(C=CC=C12)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C21H24N2O4S/c1-14-15(2)27-20-18(14)9-6-10-19(20)21(24)22-16-7-5-8-17(13-16)28(25,26)23-11-3-4-12-23/h5-10,13-15H,3-4,11-12H2,1-2H3,(H,22,24)/t14-,15-/m1/s1