3-pyridin-2-ylpropyl 4-nitrobenzoate

Systemtic Name: 3-pyridin-2-ylpropyl 4-nitrobenzoate Openeye Name: 3-(2-pyridyl)propyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 3-(2-pyridinyl)propyl ester IUPAC Name: 3-pyridin-2-ylpropyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 3-(2-pyridyl)propyl ester Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)CCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c18-15(12-6-8-14(9-7-12)17(19)20)21-11-3-5-13-4-1-2-10-16-13/h1-2,4,6-10H,3,5,11H2