N-[3-(hexanoylamino)-4-nitro-phenyl]hexanamide

Systemtic Name: N-[3-(hexanoylamino)-4-nitro-phenyl]hexanamide Openeye Name: N-[3-(hexanoylamino)-4-nitro-phenyl]hexanamide CAS Name: N-[4-nitro-3-(1-oxohexylamino)phenyl]hexanamide IUPAC Name: N-[3-(hexanoylamino)-4-nitrophenyl]hexanamide Traditional Name: N-[3-(caproylamino)-4-nitro-phenyl]hexanamide Formula: C18H27N3O4 MolecularWeight: 349.42468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CCCCC

Isomeric SMILES

CCCCCC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)CCCCC

InChI

InChI=1S/C18H27N3O4/c1-3-5-7-9-17(22)19-14-11-12-16(21(24)25)15(13-14)20-18(23)10-8-6-4-2/h11-13H,3-10H2,1-2H3,(H,19,22)(H,20,23)