5-[3-(3-azanylprop-1-ynyl)-5-nitro-indol-1-yl]-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]oxolan-3-ol

Systemtic Name: 5-[3-(3-azanylprop-1-ynyl)-5-nitro-indol-1-yl]-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]oxolan-3-ol Openeye Name: 5-[3-(3-aminoprop-1-ynyl)-5-nitro-indol-1-yl]-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]tetrahydrofuran-3-ol CAS Name: 5-[3-(3-aminoprop-1-ynyl)-5-nitro-1-indolyl]-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-oxolanol IUPAC Name: 5-[3-(3-aminoprop-1-ynyl)-5-nitroindol-1-yl]-2-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]oxolan-3-ol Traditional Name: 5-[3-(3-aminoprop-1-ynyl)-5-nitro-indol-1-yl]-2-[[bis(4-methoxyphenyl)-phenyl-methoxy]methyl]tetrahydrofuran-3-ol Formula: C37H35N3O7 MolecularWeight: 633.6897

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(CC(O4)N5C=C(C6=C5C=CC(=C6)[N+](=O)[O-])C#CCN)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC4C(CC(O4)N5C=C(C6=C5C=CC(=C6)[N+](=O)[O-])C#CCN)O

InChI

InChI=1S/C37H35N3O7/c1-44-30-15-10-27(11-16-30)37(26-8-4-3-5-9-26,28-12-17-31(45-2)18-13-28)46-24-35-34(41)22-36(47-35)39-23-25(7-6-20-38)32-21-29(40(42)43)14-19-33(32)39/h3-5,8-19,21,23,34-36,41H,20,22,24,38H2,1-2H3