3-(3-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-(4-phenylbutan-2-yl)propanamide

Systemtic Name: 3-(3-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]-N-(4-phenylbutan-2-yl)propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(3-fluorophenyl)-N-(1-methyl-3-phenyl-propyl)propanamide CAS Name: 3-(3-fluorophenyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]-N-(4-phenylbutan-2-yl)propanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(3-fluorophenyl)-N-(4-phenylbutan-2-yl)propanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(3-fluorophenyl)-N-(1-methyl-3-phenyl-propyl)propionamide Formula: C34H32FN3O3 MolecularWeight: 549.634583

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CC(C2=CC(=CC=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)CC(C2=CC(=CC=C2)F)C3=CN(C4=C3C=C(C=C4)[N+](=O)[O-])CC5=CC=CC=C5

InChI

InChI=1S/C34H32FN3O3/c1-24(15-16-25-9-4-2-5-10-25)36-34(39)21-30(27-13-8-14-28(35)19-27)32-23-37(22-26-11-6-3-7-12-26)33-18-17-29(38(40)41)20-31(32)33/h2-14,17-20,23-24,30H,15-16,21-22H2,1H3,(H,36,39)