N-[(4-fluorophenyl)methyl]-4-(1-imidazol-1-ylethyl)-2-nitro-aniline

Systemtic Name: N-[(4-fluorophenyl)methyl]-4-(1-imidazol-1-ylethyl)-2-nitro-aniline Openeye Name: N-[(4-fluorophenyl)methyl]-4-(1-imidazol-1-ylethyl)-2-nitro-aniline CAS Name: N-[(4-fluorophenyl)methyl]-4-[1-(1-imidazolyl)ethyl]-2-nitroaniline IUPAC Name: N-[(4-fluorophenyl)methyl]-4-(1-imidazol-1-ylethyl)-2-nitroaniline Traditional Name: (4-fluorobenzyl)-[4-(1-imidazol-1-ylethyl)-2-nitro-phenyl]amine Formula: C18H17FN4O2 MolecularWeight: 340.351583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)NCC2=CC=C(C=C2)F)[N+](=O)[O-])N3C=CN=C3

Isomeric SMILES

CC(C1=CC(=C(C=C1)NCC2=CC=C(C=C2)F)[N+](=O)[O-])N3C=CN=C3

InChI

InChI=1S/C18H17FN4O2/c1-13(22-9-8-20-12-22)15-4-7-17(18(10-15)23(24)25)21-11-14-2-5-16(19)6-3-14/h2-10,12-13,21H,11H2,1H3