[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-[4-(2-phenylpropan-2-yl)phenoxy]ethanoate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]acetate CAS Name: 2-[4-(2-phenylpropan-2-yl)phenoxy]acetic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-[4-(2-phenylpropan-2-yl)phenoxy]acetate Traditional Name: 2-(4-cumylphenoxy)acetic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C26H25NO6 MolecularWeight: 447.4798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(=O)OC3=C(C=C(C=C3)C=C[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(=O)OC3=C(C=C(C=C3)/C=C/[N+](=O)[O-])OC

InChI

InChI=1S/C26H25NO6/c1-26(2,20-7-5-4-6-8-20)21-10-12-22(13-11-21)32-18-25(28)33-23-14-9-19(15-16-27(29)30)17-24(23)31-3/h4-17H,18H2,1-3H3/b16-15+