4,5-dimethoxy-2-nitro-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C24H23N3O7S MolecularWeight: 497.52032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C24H23N3O7S/c1-33-22-13-20(21(27(29)30)14-23(22)34-2)24(28)25-18-9-8-16-10-11-26(15-17(16)12-18)35(31,32)19-6-4-3-5-7-19/h3-9,12-14H,10-11,15H2,1-2H3,(H,25,28)