4-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-prop-1-enyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-prop-1-enyl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-prop-1-enyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxoprop-1-enyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxoprop-1-enyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[(E)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-prop-1-enyl]-N,N-diethyl-benzenesulfonamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C=CC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H26N2O3S/c1-3-24(4-2)28(26,27)21-12-9-18(10-13-21)11-14-22(25)23-16-15-19-7-5-6-8-20(19)17-23/h5-14H,3-4,15-17H2,1-2H3/b14-11+