[2-nitro-4-(4-pentoxyphenyl)phenyl] 4-[8-(2-methylprop-2-enoyloxy)octoxy]benzoate

Systemtic Name: [2-nitro-4-(4-pentoxyphenyl)phenyl] 4-[8-(2-methylprop-2-enoyloxy)octoxy]benzoate Openeye Name: [2-nitro-4-(4-pentoxyphenyl)phenyl] 4-[8-(2-methylprop-2-enoyloxy)octoxy]benzoate CAS Name: 4-[8-(2-methyl-1-oxoprop-2-enoxy)octoxy]benzoic acid [2-nitro-4-(4-pentoxyphenyl)phenyl] ester IUPAC Name: [2-nitro-4-(4-pentoxyphenyl)phenyl] 4-[8-(2-methylprop-2-enoyloxy)octoxy]benzoate Traditional Name: 4-(8-methacryloyloxyoctoxy)benzoic acid [4-(4-amoxyphenyl)-2-nitro-phenyl] ester Formula: C36H43NO8 MolecularWeight: 617.72852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCCCOC(=O)C(=C)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCCCCOC(=O)C(=C)C)[N+](=O)[O-]

InChI

InChI=1S/C36H43NO8/c1-4-5-10-23-42-31-18-13-28(14-19-31)30-17-22-34(33(26-30)37(40)41)45-36(39)29-15-20-32(21-16-29)43-24-11-8-6-7-9-12-25-44-35(38)27(2)3/h13-22,26H,2,4-12,23-25H2,1,3H3