methyl 4-(4-methoxyphenyl)-4-nitro-butanoate

Systemtic Name: methyl 4-(4-methoxyphenyl)-4-nitro-butanoate Openeye Name: methyl 4-(4-methoxyphenyl)-4-nitro-butanoate CAS Name: 4-(4-methoxyphenyl)-4-nitrobutanoic acid methyl ester IUPAC Name: methyl 4-(4-methoxyphenyl)-4-nitrobutanoate Traditional Name: 4-(4-methoxyphenyl)-4-nitro-butyric acid methyl ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(CCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H15NO5/c1-17-10-5-3-9(4-6-10)11(13(15)16)7-8-12(14)18-2/h3-6,11H,7-8H2,1-2H3