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

Systemtic Name: 2-[2-chloranyl-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopentyl-ethanamide Openeye Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopentyl-acetamide CAS Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopentylacetamide IUPAC Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopentylacetamide Traditional Name: 2-[2-chloro-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenoxy]-N-cyclopentyl-acetamide Formula: C22H25ClN2O4S MolecularWeight: 448.9629

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

C1CCC(C1)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C22H25ClN2O4S/c23-20-13-19(9-10-21(20)29-15-22(26)24-18-7-3-4-8-18)30(27,28)25-12-11-16-5-1-2-6-17(16)14-25/h1-2,5-6,9-10,13,18H,3-4,7-8,11-12,14-15H2,(H,24,26)