4,5-dimethoxy-2-nitro-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide

Systemtic Name: 4,5-dimethoxy-2-nitro-N-(2-thiophen-2-ylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide Openeye Name: 4,5-dimethoxy-2-nitro-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 4,5-dimethoxy-2-nitro-N-[2-[oxo(thiophen-2-yl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 4,5-dimethoxy-2-nitro-N-[2-(thiophene-2-carbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 4,5-dimethoxy-2-nitro-N-[2-(2-thenoyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CC3=C(CCN(C3)C(=O)C4=CC=CS4)C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21N3O6S/c1-31-19-11-17(18(26(29)30)12-20(19)32-2)22(27)24-16-6-5-14-7-8-25(13-15(14)10-16)23(28)21-4-3-9-33-21/h3-6,9-12H,7-8,13H2,1-2H3,(H,24,27)