methyl 3-(4-methoxyphenyl)-2-nitro-heptanoate

Systemtic Name: methyl 3-(4-methoxyphenyl)-2-nitro-heptanoate Openeye Name: methyl 3-(4-methoxyphenyl)-2-nitro-heptanoate CAS Name: 3-(4-methoxyphenyl)-2-nitroheptanoic acid methyl ester IUPAC Name: methyl 3-(4-methoxyphenyl)-2-nitroheptanoate Traditional Name: 3-(4-methoxyphenyl)-2-nitro-enanthic acid methyl ester Formula: C15H21NO5 MolecularWeight: 295.33094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO5/c1-4-5-6-13(14(16(18)19)15(17)21-3)11-7-9-12(20-2)10-8-11/h7-10,13-14H,4-6H2,1-3H3