3-chloranyl-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(2-ethanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-4-methyl-benzenesulfonamide Openeye Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-chloro-4-methyl-benzenesulfonamide CAS Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-chloro-4-methylbenzenesulfonamide IUPAC Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-chloro-4-methylbenzenesulfonamide Traditional Name: N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-chloro-4-methyl-benzenesulfonamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC3=C(CCN(C3)C(=O)C)C=C2)Cl

InChI

InChI=1S/C18H19ClN2O3S/c1-12-3-6-17(10-18(12)19)25(23,24)20-16-5-4-14-7-8-21(13(2)22)11-15(14)9-16/h3-6,9-10,20H,7-8,11H2,1-2H3