N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-fluoranyl-2-nitro-aniline

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-fluoranyl-2-nitro-aniline Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-fluoro-2-nitro-aniline CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-fluoro-2-nitroaniline IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-4-fluoro-2-nitroaniline Traditional Name: 1-(1,3-benzodioxol-5-yl)ethyl-(4-fluoro-2-nitro-phenyl)amine Formula: C15H13FN2O4 MolecularWeight: 304.273123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC3=C(C=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC3=C(C=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C15H13FN2O4/c1-9(10-2-5-14-15(6-10)22-8-21-14)17-12-4-3-11(16)7-13(12)18(19)20/h2-7,9,17H,8H2,1H3