(2R)-N-(2-bromanyl-4-nitro-phenyl)-2-(3-butoxypropylamino)-2-phenyl-ethanamide

Systemtic Name: (2R)-N-(2-bromanyl-4-nitro-phenyl)-2-(3-butoxypropylamino)-2-phenyl-ethanamide Openeye Name: (2R)-N-(2-bromo-4-nitro-phenyl)-2-(3-butoxypropylamino)-2-phenyl-acetamide CAS Name: (2R)-N-(2-bromo-4-nitrophenyl)-2-(3-butoxypropylamino)-2-phenylacetamide IUPAC Name: (2R)-N-(2-bromo-4-nitrophenyl)-2-(3-butoxypropylamino)-2-phenylacetamide Traditional Name: (2R)-N-(2-bromo-4-nitro-phenyl)-2-(3-butoxypropylamino)-2-phenyl-acetamide Formula: C21H26BrN3O4 MolecularWeight: 464.35284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

Isomeric SMILES

CCCCOCCCN[C@H](C1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C21H26BrN3O4/c1-2-3-13-29-14-7-12-23-20(16-8-5-4-6-9-16)21(26)24-19-11-10-17(25(27)28)15-18(19)22/h4-6,8-11,15,20,23H,2-3,7,12-14H2,1H3,(H,24,26)/t20-/m1/s1