[4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [4-(4-chloro-2-nitro-phenoxy)-3-methoxy-phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [4-(4-chloro-2-nitrophenoxy)-3-methoxyphenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [4-(4-chloro-2-nitrophenoxy)-3-methoxyphenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [4-(4-chloro-2-nitro-phenoxy)-3-methoxy-phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C25H23ClN2O7 MolecularWeight: 498.91232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=C(C=C3)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=C(C=C3)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C25H23ClN2O7/c1-32-22-11-16(4-6-21(22)35-20-7-5-18(26)13-19(20)28(30)31)25(29)27-9-8-15-10-23(33-2)24(34-3)12-17(15)14-27/h4-7,10-13H,8-9,14H2,1-3H3