methyl 2-[[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-5-nitro-benzoate

Systemtic Name: methyl 2-[[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-5-nitro-benzoate Openeye Name: methyl 2-[[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-5-nitro-benzoate CAS Name: 2-[[(4-fluorophenyl)-(1-methyl-2-imidazolyl)methyl]amino]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-[[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-5-nitrobenzoate Traditional Name: 2-[[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]amino]-5-nitro-benzoic acid methyl ester Formula: C19H17FN4O4 MolecularWeight: 384.361083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)F)NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)F)NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H17FN4O4/c1-23-10-9-21-18(23)17(12-3-5-13(20)6-4-12)22-16-8-7-14(24(26)27)11-15(16)19(25)28-2/h3-11,17,22H,1-2H3