N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-cyclopropyl-N-(4-fluorobenzyl)-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C21H20FN3O5 MolecularWeight: 413.399003

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)F)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)F)C(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H20FN3O5/c22-15-5-3-14(4-6-15)13-24(16-7-8-16)20(26)2-1-11-23-18-10-9-17(25(28)29)12-19(18)30-21(23)27/h3-6,9-10,12,16H,1-2,7-8,11,13H2