[4-(9-cyclopropylnonanoyloxy)-2,5-dinitro-phenyl] 9-cyclopropylnonanoate

Systemtic Name: [4-(9-cyclopropylnonanoyloxy)-2,5-dinitro-phenyl] 9-cyclopropylnonanoate Openeye Name: [4-(9-cyclopropylnonanoyloxy)-2,5-dinitro-phenyl] 9-cyclopropylnonanoate CAS Name: 9-cyclopropylnonanoic acid [4-(9-cyclopropyl-1-oxononoxy)-2,5-dinitrophenyl] ester IUPAC Name: [4-(9-cyclopropylnonanoyloxy)-2,5-dinitrophenyl] 9-cyclopropylnonanoate Traditional Name: 9-cyclopropylpelargonic acid [4-(9-cyclopropylnonanoyloxy)-2,5-dinitro-phenyl] ester Formula: C30H44N2O8 MolecularWeight: 560.67896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CCCCCCCCC(=O)OC2=CC(=C(C=C2[N+](=O)[O-])OC(=O)CCCCCCCCC3CC3)[N+](=O)[O-]

Isomeric SMILES

C1CC1CCCCCCCCC(=O)OC2=CC(=C(C=C2[N+](=O)[O-])OC(=O)CCCCCCCCC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C30H44N2O8/c33-29(15-11-7-3-1-5-9-13-23-17-18-23)39-27-21-26(32(37)38)28(22-25(27)31(35)36)40-30(34)16-12-8-4-2-6-10-14-24-19-20-24/h21-24H,1-20H2