methyl 3-(4-butoxy-3-nitro-5-phenyl-phenyl)propanoate

Systemtic Name: methyl 3-(4-butoxy-3-nitro-5-phenyl-phenyl)propanoate Openeye Name: methyl 3-(4-butoxy-3-nitro-5-phenyl-phenyl)propanoate CAS Name: 3-(4-butoxy-3-nitro-5-phenylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(4-butoxy-3-nitro-5-phenylphenyl)propanoate Traditional Name: 3-(4-butoxy-3-nitro-5-phenyl-phenyl)propionic acid methyl ester Formula: C20H23NO5 MolecularWeight: 357.40032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1C2=CC=CC=C2)CCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=C(C=C(C=C1C2=CC=CC=C2)CCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H23NO5/c1-3-4-12-26-20-17(16-8-6-5-7-9-16)13-15(10-11-19(22)25-2)14-18(20)21(23)24/h5-9,13-14H,3-4,10-12H2,1-2H3