(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (4-chloro-3-morpholinosulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [4-chloro-3-(4-morpholinylsulfonyl)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (4-chloro-3-morpholin-4-ylsulfonylphenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (4-chloro-3-morpholinosulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C20H21ClN2O4S MolecularWeight: 420.90974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H21ClN2O4S/c21-18-6-5-16(13-19(18)28(25,26)23-9-11-27-12-10-23)20(24)22-8-7-15-3-1-2-4-17(15)14-22/h1-6,13H,7-12,14H2