5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)pentanenitrile

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)pentanenitrile Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)pentanenitrile CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)pentanenitrile IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)pentanenitrile Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)valeronitrile Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O2S/c15-9-4-1-5-11-19(17,18)16-10-8-13-6-2-3-7-14(13)12-16/h2-3,6-7H,1,4-5,8,10-12H2