(3Z)-3-diphenoxyphosphorylimino-1-ethenyl-2-[(5-nitrofuran-2-yl)methyl]-1,4-dihydroisoquinolin-7-ol

Systemtic Name: (3Z)-3-diphenoxyphosphorylimino-1-ethenyl-2-[(5-nitrofuran-2-yl)methyl]-1,4-dihydroisoquinolin-7-ol Openeye Name: (3Z)-3-diphenoxyphosphorylimino-2-[(5-nitro-2-furyl)methyl]-1-vinyl-1,4-dihydroisoquinolin-7-ol CAS Name: (3Z)-3-diphenoxyphosphorylimino-1-ethenyl-2-[(5-nitro-2-furanyl)methyl]-1,4-dihydroisoquinolin-7-ol IUPAC Name: (3Z)-3-diphenoxyphosphorylimino-1-ethenyl-2-[(5-nitrofuran-2-yl)methyl]-1,4-dihydroisoquinolin-7-ol Traditional Name: (3Z)-3-diphenoxyphosphorylimino-2-[(5-nitro-2-furyl)methyl]-1-vinyl-1,4-dihydroisoquinolin-7-ol Formula: C28H24N3O7P MolecularWeight: 545.479821

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1C2=C(CC(=NP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)N1CC5=CC=C(O5)[N+](=O)[O-])C=CC(=C2)O

Isomeric SMILES

C=CC1C2=C(C/C(=N/P(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)/N1CC5=CC=C(O5)[N+](=O)[O-])C=CC(=C2)O

InChI

InChI=1S/C28H24N3O7P/c1-2-26-25-18-21(32)14-13-20(25)17-27(30(26)19-24-15-16-28(36-24)31(33)34)29-39(35,37-22-9-5-3-6-10-22)38-23-11-7-4-8-12-23/h2-16,18,26,32H,1,17,19H2/b29-27-