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

Systemtic Name: N-[4-(hexanoylamino)-3-nitro-phenyl]hexanamide Openeye Name: N-[4-(hexanoylamino)-3-nitro-phenyl]hexanamide CAS Name: N-[3-nitro-4-(1-oxohexylamino)phenyl]hexanamide IUPAC Name: N-[4-(hexanoylamino)-3-nitrophenyl]hexanamide Traditional Name: N-[4-(caproylamino)-3-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)NC(=O)CCCCC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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