(2S)-N-(2-bromanyl-4-nitro-phenyl)-2-(2-diethylaminoethylamino)-2-phenyl-ethanamide

Systemtic Name: (2S)-N-(2-bromanyl-4-nitro-phenyl)-2-(2-diethylaminoethylamino)-2-phenyl-ethanamide Openeye Name: (2S)-N-(2-bromo-4-nitro-phenyl)-2-(2-diethylaminoethylamino)-2-phenyl-acetamide CAS Name: (2S)-N-(2-bromo-4-nitrophenyl)-2-(2-diethylaminoethylamino)-2-phenylacetamide IUPAC Name: (2S)-N-(2-bromo-4-nitrophenyl)-2-(2-diethylaminoethylamino)-2-phenylacetamide Traditional Name: (2S)-N-(2-bromo-4-nitro-phenyl)-2-(2-diethylaminoethylamino)-2-phenyl-acetamide Formula: C20H25BrN4O3 MolecularWeight: 449.3415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25BrN4O3/c1-3-24(4-2)13-12-22-19(15-8-6-5-7-9-15)20(26)23-18-11-10-16(25(27)28)14-17(18)21/h5-11,14,19,22H,3-4,12-13H2,1-2H3,(H,23,26)/t19-/m0/s1