(4-nitrophenyl) 12-methyltridecanoate

Systemtic Name: (4-nitrophenyl) 12-methyltridecanoate Openeye Name: (4-nitrophenyl) 12-methyltridecanoate CAS Name: 12-methyltridecanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 12-methyltridecanoate Traditional Name: 12-methyltridecanoic acid (4-nitrophenyl) ester Formula: C20H31NO4 MolecularWeight: 349.46444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCCCCCCCCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C20H31NO4/c1-17(2)11-9-7-5-3-4-6-8-10-12-20(22)25-19-15-13-18(14-16-19)21(23)24/h13-17H,3-12H2,1-2H3