[1-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [1-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [1-(4-bromo-2-chloro-phenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-(4-bromo-2-chlorophenyl)sulfonyl-4-piperidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-(4-bromo-2-chlorophenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-(4-bromo-2-chloro-phenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C21H22BrClN2O3S MolecularWeight: 497.83298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C21H22BrClN2O3S/c22-18-5-6-20(19(23)13-18)29(27,28)25-11-8-16(9-12-25)21(26)24-10-7-15-3-1-2-4-17(15)14-24/h1-6,13,16H,7-12,14H2