2-(4-chloranylphenoxy)-2-methyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide Openeye Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)propionamide Formula: C22H27ClN2O4S MolecularWeight: 450.97878

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H27ClN2O4S/c1-4-13-30(27,28)25-12-11-16-5-8-19(14-17(16)15-25)24-21(26)22(2,3)29-20-9-6-18(23)7-10-20/h5-10,14H,4,11-13,15H2,1-3H3,(H,24,26)