4-chloranyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-(4-methoxyphenyl)-3-nitro-benzenesulfonamide Formula: C24H22ClN3O6S MolecularWeight: 515.96598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H22ClN3O6S/c1-34-20-8-6-19(7-9-20)27(35(32,33)21-10-11-22(25)23(14-21)28(30)31)16-24(29)26-13-12-17-4-2-3-5-18(17)15-26/h2-11,14H,12-13,15-16H2,1H3