6-methoxy-2-[(5-nitrofuran-2-yl)methyl]-1-(2-phenylethynyl)-3,4-dihydro-1H-isoquinolin-7-ol

Systemtic Name: 6-methoxy-2-[(5-nitrofuran-2-yl)methyl]-1-(2-phenylethynyl)-3,4-dihydro-1H-isoquinolin-7-ol Openeye Name: 6-methoxy-2-[(5-nitro-2-furyl)methyl]-1-(2-phenylethynyl)-3,4-dihydro-1H-isoquinolin-7-ol CAS Name: 6-methoxy-2-[(5-nitro-2-furanyl)methyl]-1-(2-phenylethynyl)-3,4-dihydro-1H-isoquinolin-7-ol IUPAC Name: 6-methoxy-2-[(5-nitrofuran-2-yl)methyl]-1-(2-phenylethynyl)-3,4-dihydro-1H-isoquinolin-7-ol Traditional Name: 6-methoxy-2-[(5-nitro-2-furyl)methyl]-1-(2-phenylethynyl)-3,4-dihydro-1H-isoquinolin-7-ol Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC3=CC=C(O3)[N+](=O)[O-])C#CC4=CC=CC=C4)O

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC3=CC=C(O3)[N+](=O)[O-])C#CC4=CC=CC=C4)O

InChI

InChI=1S/C23H20N2O5/c1-29-22-13-17-11-12-24(15-18-8-10-23(30-18)25(27)28)20(19(17)14-21(22)26)9-7-16-5-3-2-4-6-16/h2-6,8,10,13-14,20,26H,11-12,15H2,1H3