N-[3-(heptanoylamino)-4-nitro-phenyl]heptanamide

Systemtic Name: N-[3-(heptanoylamino)-4-nitro-phenyl]heptanamide Openeye Name: N-[3-(heptanoylamino)-4-nitro-phenyl]heptanamide CAS Name: N-[4-nitro-3-(1-oxoheptylamino)phenyl]heptanamide IUPAC Name: N-[3-(heptanoylamino)-4-nitrophenyl]heptanamide Traditional Name: N-[3-(enanthylamino)-4-nitro-phenyl]enanthamide Formula: C20H31N3O4 MolecularWeight: 377.47784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O4/c1-3-5-7-9-11-19(24)21-16-13-14-18(23(26)27)17(15-16)22-20(25)12-10-8-6-4-2/h13-15H,3-12H2,1-2H3,(H,21,24)(H,22,25)