4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)butanenitrile

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)butanenitrile Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)butanenitrile CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)butanenitrile IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)butanenitrile Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)butyronitrile Formula: C13H16N2O2S MolecularWeight: 264.34334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCCC#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)CCCC#N

InChI

InChI=1S/C13H16N2O2S/c14-8-3-4-10-18(16,17)15-9-7-12-5-1-2-6-13(12)11-15/h1-2,5-6H,3-4,7,9-11H2