(4-methoxyphenyl) 3-(5-nitro-2-undecoxy-phenyl)oxirane-2-carboxylate

Systemtic Name: (4-methoxyphenyl) 3-(5-nitro-2-undecoxy-phenyl)oxirane-2-carboxylate Openeye Name: (4-methoxyphenyl) 3-(5-nitro-2-undecoxy-phenyl)oxirane-2-carboxylate CAS Name: 3-(5-nitro-2-undecoxyphenyl)-2-oxiranecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-(5-nitro-2-undecoxyphenyl)oxirane-2-carboxylate Traditional Name: 3-(5-nitro-2-undecoxy-phenyl)oxirane-2-carboxylic acid (4-methoxyphenyl) ester Formula: C27H35NO7 MolecularWeight: 485.5693

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])C2C(O2)C(=O)OC3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCCCCCCCOC1=C(C=C(C=C1)[N+](=O)[O-])C2C(O2)C(=O)OC3=CC=C(C=C3)OC

InChI

InChI=1S/C27H35NO7/c1-3-4-5-6-7-8-9-10-11-18-33-24-17-12-20(28(30)31)19-23(24)25-26(35-25)27(29)34-22-15-13-21(32-2)14-16-22/h12-17,19,25-26H,3-11,18H2,1-2H3