(1S,2S)-N-(2-bromanyl-4-nitro-phenyl)-2-phenyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2S)-N-(2-bromanyl-4-nitro-phenyl)-2-phenyl-cyclopropane-1-carboxamide Openeye Name: (1S,2S)-N-(2-bromo-4-nitro-phenyl)-2-phenyl-cyclopropanecarboxamide CAS Name: (1S,2S)-N-(2-bromo-4-nitrophenyl)-2-phenyl-1-cyclopropanecarboxamide IUPAC Name: (1S,2S)-N-(2-bromo-4-nitrophenyl)-2-phenylcyclopropane-1-carboxamide Traditional Name: (1S,2S)-N-(2-bromo-4-nitro-phenyl)-2-phenyl-cyclopropanecarboxamide Formula: C16H13BrN2O3 MolecularWeight: 361.19002

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C3=CC=CC=C3

Isomeric SMILES

C1[C@@H]([C@H]1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C3=CC=CC=C3

InChI

InChI=1S/C16H13BrN2O3/c17-14-8-11(19(21)22)6-7-15(14)18-16(20)13-9-12(13)10-4-2-1-3-5-10/h1-8,12-13H,9H2,(H,18,20)/t12-,13+/m1/s1