N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanesulfonamide

Systemtic Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanesulfonamide Openeye Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanesulfonamide CAS Name: N-[2-(2-methyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanesulfonamide IUPAC Name: N-[2-(2-methylpropanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]ethanesulfonamide Traditional Name: N-(2-isobutyryl-3,4-dihydro-1H-isoquinolin-7-yl)ethanesulfonamide Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

Isomeric SMILES

CCS(=O)(=O)NC1=CC2=C(CCN(C2)C(=O)C(C)C)C=C1

InChI

InChI=1S/C15H22N2O3S/c1-4-21(19,20)16-14-6-5-12-7-8-17(10-13(12)9-14)15(18)11(2)3/h5-6,9,11,16H,4,7-8,10H2,1-3H3