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

Systemtic Name: 3-(3-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-propyl-propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(3-fluorophenyl)-N-propyl-propanamide CAS Name: 3-(3-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-N-propylpropanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(3-fluorophenyl)-N-propylpropanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(3-fluorophenyl)-N-propyl-propionamide Formula: C27H26FN3O3 MolecularWeight: 459.512043

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CC(C1=CC(=CC=C1)F)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

CCCNC(=O)CC(C1=CC(=CC=C1)F)C2=CN(C3=C2C=C(C=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C27H26FN3O3/c1-2-13-29-27(32)16-23(20-9-6-10-21(28)14-20)25-18-30(17-19-7-4-3-5-8-19)26-12-11-22(31(33)34)15-24(25)26/h3-12,14-15,18,23H,2,13,16-17H2,1H3,(H,29,32)