(3-nitrophenyl) 4-(5-pentylpyridin-2-yl)benzoate

Systemtic Name: (3-nitrophenyl) 4-(5-pentylpyridin-2-yl)benzoate Openeye Name: (3-nitrophenyl) 4-(5-pentyl-2-pyridyl)benzoate CAS Name: 4-(5-pentyl-2-pyridinyl)benzoic acid (3-nitrophenyl) ester IUPAC Name: (3-nitrophenyl) 4-(5-pentylpyridin-2-yl)benzoate Traditional Name: 4-(5-amyl-2-pyridyl)benzoic acid (3-nitrophenyl) ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H22N2O4/c1-2-3-4-6-17-9-14-22(24-16-17)18-10-12-19(13-11-18)23(26)29-21-8-5-7-20(15-21)25(27)28/h5,7-16H,2-4,6H2,1H3