(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (2-chloro-5-morpholinosulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [2-chloro-5-(4-morpholinylsulfonyl)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (2-chloro-5-morpholin-4-ylsulfonylphenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (2-chloro-5-morpholinosulfonyl-phenyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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