3-(4-fluorophenyl)-1-morpholin-4-yl-3-[5-nitro-1-(phenylmethyl)indol-3-yl]propan-1-one

Systemtic Name: 3-(4-fluorophenyl)-1-morpholin-4-yl-3-[5-nitro-1-(phenylmethyl)indol-3-yl]propan-1-one Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-1-morpholino-propan-1-one CAS Name: 3-(4-fluorophenyl)-1-(4-morpholinyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-1-propanone IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(4-fluorophenyl)-1-morpholin-4-ylpropan-1-one Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-1-morpholino-propan-1-one Formula: C28H26FN3O4 MolecularWeight: 487.522143

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC(C2=CC=C(C=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1COCCN1C(=O)CC(C2=CC=C(C=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C28H26FN3O4/c29-22-8-6-21(7-9-22)24(17-28(33)30-12-14-36-15-13-30)26-19-31(18-20-4-2-1-3-5-20)27-11-10-23(32(34)35)16-25(26)27/h1-11,16,19,24H,12-15,17-18H2