1-[5-dibutoxyphosphoryl-4-(dibutoxyphosphorylmethyl)pentyl]-2,4-dinitro-benzene

Systemtic Name: 1-[5-dibutoxyphosphoryl-4-(dibutoxyphosphorylmethyl)pentyl]-2,4-dinitro-benzene Openeye Name: 1-[5-dibutoxyphosphoryl-4-(dibutoxyphosphorylmethyl)pentyl]-2,4-dinitro-benzene CAS Name: 1-[5-dibutoxyphosphoryl-4-(dibutoxyphosphorylmethyl)pentyl]-2,4-dinitrobenzene IUPAC Name: 1-[5-dibutoxyphosphoryl-4-(dibutoxyphosphorylmethyl)pentyl]-2,4-dinitrobenzene Traditional Name: 1-[5-dibutoxyphosphoryl-4-(dibutoxyphosphorylmethyl)pentyl]-2,4-dinitro-benzene Formula: C28H50N2O10P2 MolecularWeight: 636.651522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(CC(CCCC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CP(=O)(OCCCC)OCCCC)OCCCC

Isomeric SMILES

CCCCOP(=O)(CC(CCCC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])CP(=O)(OCCCC)OCCCC)OCCCC

InChI

InChI=1S/C28H50N2O10P2/c1-5-9-18-37-41(35,38-19-10-6-2)23-25(24-42(36,39-20-11-7-3)40-21-12-8-4)14-13-15-26-16-17-27(29(31)32)22-28(26)30(33)34/h16-17,22,25H,5-15,18-21,23-24H2,1-4H3