4-nitro-4-[3-oxidanylidene-3-(phenylmethoxyamino)propyl]-N,N'-bis(phenylmethoxy)heptanediamide

Systemtic Name: 4-nitro-4-[3-oxidanylidene-3-(phenylmethoxyamino)propyl]-N,N'-bis(phenylmethoxy)heptanediamide Openeye Name: N,N'-dibenzyloxy-4-[3-(benzyloxyamino)-3-oxo-propyl]-4-nitro-heptanediamide CAS Name: 4-nitro-4-[3-oxo-3-(phenylmethoxyamino)propyl]-N,N'-bis(phenylmethoxy)heptanediamide IUPAC Name: 4-nitro-4-[3-oxo-3-(phenylmethoxyamino)propyl]-N,N'-bis(phenylmethoxy)heptanediamide Traditional Name: N,N'-dibenzoxy-4-[3-(benzoxyamino)-3-keto-propyl]-4-nitro-pimelamide Formula: C31H36N4O8 MolecularWeight: 592.63954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CONC(=O)CCC(CCC(=O)NOCC2=CC=CC=C2)(CCC(=O)NOCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CONC(=O)CCC(CCC(=O)NOCC2=CC=CC=C2)(CCC(=O)NOCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C31H36N4O8/c36-28(32-41-22-25-10-4-1-5-11-25)16-19-31(35(39)40,20-17-29(37)33-42-23-26-12-6-2-7-13-26)21-18-30(38)34-43-24-27-14-8-3-9-15-27/h1-15H,16-24H2,(H,32,36)(H,33,37)(H,34,38)