methyl 2-methoxy-3-[1-(2-methoxy-3-methoxycarbonyl-5-nitro-phenyl)dodec-1-enyl]-5-nitro-benzoate

Systemtic Name: methyl 2-methoxy-3-[1-(2-methoxy-3-methoxycarbonyl-5-nitro-phenyl)dodec-1-enyl]-5-nitro-benzoate Openeye Name: methyl 2-methoxy-3-[1-(2-methoxy-3-methoxycarbonyl-5-nitro-phenyl)dodec-1-enyl]-5-nitro-benzoate CAS Name: 2-methoxy-3-[1-(2-methoxy-3-methoxycarbonyl-5-nitrophenyl)dodec-1-enyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-methoxy-3-[1-(2-methoxy-3-methoxycarbonyl-5-nitrophenyl)dodec-1-enyl]-5-nitrobenzoate Traditional Name: 3-[1-(3-carbomethoxy-2-methoxy-5-nitro-phenyl)dodec-1-enyl]-2-methoxy-5-nitro-benzoic acid methyl ester Formula: C30H38N2O10 MolecularWeight: 586.63012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=C(C1=CC(=CC(=C1OC)C(=O)OC)[N+](=O)[O-])C2=CC(=CC(=C2OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCC=C(C1=CC(=CC(=C1OC)C(=O)OC)[N+](=O)[O-])C2=CC(=CC(=C2OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C30H38N2O10/c1-6-7-8-9-10-11-12-13-14-15-22(23-16-20(31(35)36)18-25(27(23)39-2)29(33)41-4)24-17-21(32(37)38)19-26(28(24)40-3)30(34)42-5/h15-19H,6-14H2,1-5H3