N-[(4-fluorophenyl)methyl]-2-nitro-5-piperazin-1-yl-aniline

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-nitro-5-piperazin-1-yl-aniline Openeye Name: N-[(4-fluorophenyl)methyl]-2-nitro-5-piperazin-1-yl-aniline CAS Name: N-[(4-fluorophenyl)methyl]-2-nitro-5-(1-piperazinyl)aniline IUPAC Name: N-[(4-fluorophenyl)methyl]-2-nitro-5-piperazin-1-ylaniline Traditional Name: (4-fluorobenzyl)-(2-nitro-5-piperazino-phenyl)amine Formula: C17H19FN4O2 MolecularWeight: 330.356763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1)C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H19FN4O2/c18-14-3-1-13(2-4-14)12-20-16-11-15(5-6-17(16)22(23)24)21-9-7-19-8-10-21/h1-6,11,19-20H,7-10,12H2