(1R,2R,3R)-1-(1H-indol-3-yl)-2-nitro-1-phenyl-octan-3-ol

Systemtic Name: (1R,2R,3R)-1-(1H-indol-3-yl)-2-nitro-1-phenyl-octan-3-ol Openeye Name: (1R,2R,3R)-1-(1H-indol-3-yl)-2-nitro-1-phenyl-octan-3-ol CAS Name: (1R,2R,3R)-1-(1H-indol-3-yl)-2-nitro-1-phenyl-3-octanol IUPAC Name: (1R,2R,3R)-1-(1H-indol-3-yl)-2-nitro-1-phenyloctan-3-ol Traditional Name: (1R,2R,3R)-1-(1H-indol-3-yl)-2-nitro-1-phenyl-octan-3-ol Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C(C1=CC=CC=C1)C2=CNC3=CC=CC=C32)[N+](=O)[O-])O

Isomeric SMILES

CCCCC[C@H]([C@@H]([C@H](C1=CC=CC=C1)C2=CNC3=CC=CC=C32)[N+](=O)[O-])O

InChI

InChI=1S/C22H26N2O3/c1-2-3-5-14-20(25)22(24(26)27)21(16-10-6-4-7-11-16)18-15-23-19-13-9-8-12-17(18)19/h4,6-13,15,20-23,25H,2-3,5,14H2,1H3/t20-,21-,22+/m1/s1