2-(4-nitrophenyl)hexadecanoic acid

Systemtic Name: 2-(4-nitrophenyl)hexadecanoic acid Openeye Name: 2-(4-nitrophenyl)hexadecanoic acid CAS Name: 2-(4-nitrophenyl)hexadecanoic acid IUPAC Name: 2-(4-nitrophenyl)hexadecanoic acid Traditional Name: 2-(4-nitrophenyl)palmitic acid Formula: C22H35NO4 MolecularWeight: 377.5176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21(22(24)25)19-15-17-20(18-16-19)23(26)27/h15-18,21H,2-14H2,1H3,(H,24,25)