3-bromanyl-N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]benzamide

Systemtic Name: 3-bromanyl-N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]benzamide Openeye Name: 3-bromo-N-[3-(2-chloro-4-nitro-anilino)propyl]benzamide CAS Name: 3-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzamide IUPAC Name: 3-bromo-N-[3-(2-chloro-4-nitroanilino)propyl]benzamide Traditional Name: 3-bromo-N-[3-(2-chloro-4-nitro-anilino)propyl]benzamide Formula: C16H15BrClN3O3 MolecularWeight: 412.6656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H15BrClN3O3/c17-12-4-1-3-11(9-12)16(22)20-8-2-7-19-15-6-5-13(21(23)24)10-14(15)18/h1,3-6,9-10,19H,2,7-8H2,(H,20,22)