2-[2-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[2-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopropyl-ethanamide Openeye Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopropyl-acetamide CAS Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopropylacetamide IUPAC Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopropylacetamide Traditional Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopropyl-acetamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

C1CC1NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

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