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

Systemtic Name: 3-(4-fluorophenyl)-N-(3-methoxypropyl)-3-[5-nitro-1-(phenylmethyl)indol-3-yl]propanamide Openeye Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-N-(3-methoxypropyl)propanamide CAS Name: 3-(4-fluorophenyl)-N-(3-methoxypropyl)-3-[5-nitro-1-(phenylmethyl)-3-indolyl]propanamide IUPAC Name: 3-(1-benzyl-5-nitroindol-3-yl)-3-(4-fluorophenyl)-N-(3-methoxypropyl)propanamide Traditional Name: 3-(1-benzyl-5-nitro-indol-3-yl)-3-(4-fluorophenyl)-N-(3-methoxypropyl)propionamide Formula: C28H28FN3O4 MolecularWeight: 489.538023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28FN3O4/c1-36-15-5-14-30-28(33)17-24(21-8-10-22(29)11-9-21)26-19-31(18-20-6-3-2-4-7-20)27-13-12-23(32(34)35)16-25(26)27/h2-4,6-13,16,19,24H,5,14-15,17-18H2,1H3,(H,30,33)