2-[[2,5-bis(chloranyl)phenyl]sulfonyl-piperidin-4-yl-methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[2,5-bis(chloranyl)phenyl]sulfonyl-piperidin-4-yl-methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(2,5-dichlorophenyl)sulfonyl-(4-piperidyl)methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(2,5-dichlorophenyl)sulfonyl-(4-piperidinyl)methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(2,5-dichlorophenyl)sulfonyl-piperidin-4-ylmethyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[(2,5-dichlorophenyl)sulfonyl-(4-piperidyl)methyl]-3,4-dihydro-1H-isoquinoline Formula: C21H24Cl2N2O2S MolecularWeight: 439.39846

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C1CNCCC1C(N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O2S/c22-18-5-6-19(23)20(13-18)28(26,27)21(16-7-10-24-11-8-16)25-12-9-15-3-1-2-4-17(15)14-25/h1-6,13,16,21,24H,7-12,14H2