N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-3-(2-nitroanilino)propanamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-3-(2-nitroanilino)propanamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-3-(2-nitroanilino)propionamide Formula: C16H15BrFN3O3 MolecularWeight: 396.211003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCCC(=O)NCC2=C(C=CC(=C2)Br)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NCCC(=O)NCC2=C(C=CC(=C2)Br)F)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrFN3O3/c17-12-5-6-13(18)11(9-12)10-20-16(22)7-8-19-14-3-1-2-4-15(14)21(23)24/h1-6,9,19H,7-8,10H2,(H,20,22)