1-[2-methoxy-3,6-bis(methoxymethoxy)-5-nitro-phenyl]propan-2-yl 5-ethyl-2,4-bis(methoxymethoxy)benzoate

Systemtic Name: 1-[2-methoxy-3,6-bis(methoxymethoxy)-5-nitro-phenyl]propan-2-yl 5-ethyl-2,4-bis(methoxymethoxy)benzoate Openeye Name: [2-[2-methoxy-3,6-bis(methoxymethoxy)-5-nitro-phenyl]-1-methyl-ethyl] 5-ethyl-2,4-bis(methoxymethoxy)benzoate CAS Name: 5-ethyl-2,4-bis(methoxymethoxy)benzoic acid 1-[2-methoxy-3,6-bis(methoxymethoxy)-5-nitrophenyl]propan-2-yl ester IUPAC Name: 1-[2-methoxy-3,6-bis(methoxymethoxy)-5-nitrophenyl]propan-2-yl 5-ethyl-2,4-bis(methoxymethoxy)benzoate Traditional Name: 5-ethyl-2,4-bis(methoxymethoxy)benzoic acid [2-[2-methoxy-3,6-bis(methoxymethoxy)-5-nitro-phenyl]-1-methyl-ethyl] ester Formula: C27H37NO13 MolecularWeight: 583.58158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)OC(C)CC2=C(C(=CC(=C2OC)OCOC)[N+](=O)[O-])OCOC)OCOC)OCOC

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)OC(C)CC2=C(C(=CC(=C2OC)OCOC)[N+](=O)[O-])OCOC)OCOC)OCOC

InChI

InChI=1S/C27H37NO13/c1-8-18-10-19(23(38-14-33-4)12-22(18)37-13-32-3)27(29)41-17(2)9-20-25(40-16-35-6)21(28(30)31)11-24(26(20)36-7)39-15-34-5/h10-12,17H,8-9,13-16H2,1-7H3