3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-phenethyl-propanamide

Systemtic Name: 3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-phenethyl-propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-N-phenethyl-propanamide CAS Name: 3-(4-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-N-phenethylpropanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(4-fluorophenyl)-N-phenethylpropanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-N-phenethyl-propionamide Formula: C32H28FN3O3 MolecularWeight: 521.581423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=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/C32H28FN3O3/c33-26-13-11-25(12-14-26)28(20-32(37)34-18-17-23-7-3-1-4-8-23)30-22-35(21-24-9-5-2-6-10-24)31-16-15-27(36(38)39)19-29(30)31/h1-16,19,22,28H,17-18,20-21H2,(H,34,37)