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

Systemtic Name: 3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(4-fluorophenyl)-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-1-pyrrolidino-propan-1-one Formula: C28H26FN3O3 MolecularWeight: 471.522743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CC(C2=CC=C(C=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=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/C28H26FN3O3/c29-22-10-8-21(9-11-22)24(17-28(33)30-14-4-5-15-30)26-19-31(18-20-6-2-1-3-7-20)27-13-12-23(32(34)35)16-25(26)27/h1-3,6-13,16,19,24H,4-5,14-15,17-18H2