N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-fluoranyl-aniline

Systemtic Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-fluoranyl-aniline Openeye Name: N-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-3-fluoro-aniline CAS Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3-fluoroaniline IUPAC Name: N-[(4,5-dimethoxy-2-nitrophenyl)methyl]-3-fluoroaniline Traditional Name: (4,5-dimethoxy-2-nitro-benzyl)-(3-fluorophenyl)amine Formula: C15H15FN2O4 MolecularWeight: 306.289003

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CNC2=CC(=CC=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CNC2=CC(=CC=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C15H15FN2O4/c1-21-14-6-10(13(18(19)20)8-15(14)22-2)9-17-12-5-3-4-11(16)7-12/h3-8,17H,9H2,1-2H3