3-chloranyl-2,2-dimethyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]propanamide

Systemtic Name: 3-chloranyl-2,2-dimethyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]propanamide Openeye Name: 3-chloro-2,2-dimethyl-N-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide CAS Name: 3-chloro-2,2-dimethyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]propanamide IUPAC Name: 3-chloro-2,2-dimethyl-N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]propanamide Traditional Name: 3-chloro-2,2-dimethyl-N-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)propionamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C(C)(C)CCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C(C)(C)CCl

InChI

InChI=1S/C21H25ClN2O3S/c1-15-4-8-19(9-5-15)28(26,27)24-11-10-16-6-7-18(12-17(16)13-24)23-20(25)21(2,3)14-22/h4-9,12H,10-11,13-14H2,1-3H3,(H,23,25)