2-chloranyl-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: 2-chloranyl-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 2-chloro-N-(2,3-dihydrobenzofuran-2-ylmethyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: 2-chloro-N-(2,3-dihydrobenzofuran-2-ylmethyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 2-chloro-N-(coumaran-2-ylmethyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C25H23ClN2O4S MolecularWeight: 482.97912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NCC4CC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NCC4CC5=CC=CC=C5O4

InChI

InChI=1S/C25H23ClN2O4S/c26-23-10-9-21(33(30,31)28-12-11-17-5-1-2-7-19(17)16-28)14-22(23)25(29)27-15-20-13-18-6-3-4-8-24(18)32-20/h1-10,14,20H,11-13,15-16H2,(H,27,29)