11-oxabicyclo[4.4.1]undecan-6-yl 4-nitrobenzoate

Systemtic Name: 11-oxabicyclo[4.4.1]undecan-6-yl 4-nitrobenzoate Openeye Name: 11-oxabicyclo[4.4.1]undecan-6-yl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 11-oxabicyclo[4.4.1]undecan-6-yl ester IUPAC Name: 11-oxabicyclo[4.4.1]undecan-6-yl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 11-oxabicyclo[4.4.1]undecan-6-yl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CCCCC(C1)O2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(CCCCC(C1)O2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21NO5/c19-16(13-7-9-14(10-8-13)18(20)21)23-17-11-3-1-5-15(22-17)6-2-4-12-17/h7-10,15H,1-6,11-12H2