N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-[(4-nitrophenyl)amino]butanamide

Systemtic Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-[(4-nitrophenyl)amino]butanamide Openeye Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(4-nitroanilino)butanamide CAS Name: N-[(2-fluorophenyl)-(1-methyl-2-imidazolyl)methyl]-4-(4-nitroanilino)butanamide IUPAC Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(4-nitroanilino)butanamide Traditional Name: N-[(2-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-4-(4-nitroanilino)butyramide Formula: C21H22FN5O3 MolecularWeight: 411.429483

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2F)NC(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2F)NC(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H22FN5O3/c1-26-14-13-24-21(26)20(17-5-2-3-6-18(17)22)25-19(28)7-4-12-23-15-8-10-16(11-9-15)27(29)30/h2-3,5-6,8-11,13-14,20,23H,4,7,12H2,1H3,(H,25,28)