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

Systemtic Name: azepan-1-yl-[2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone Openeye Name: azepan-1-yl-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone CAS Name: 1-azepanyl-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone IUPAC Name: azepan-1-yl-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone Traditional Name: azepan-1-yl-[2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)phenyl]methanone Formula: C22H25ClN2O3S MolecularWeight: 432.9635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C22H25ClN2O3S/c23-21-10-9-19(15-20(21)22(26)24-12-5-1-2-6-13-24)29(27,28)25-14-11-17-7-3-4-8-18(17)16-25/h3-4,7-10,15H,1-2,5-6,11-14,16H2