[4-(4-nitrophenoxy)-2-oxidanyl-butyl] decanoate

Systemtic Name: [4-(4-nitrophenoxy)-2-oxidanyl-butyl] decanoate Openeye Name: [2-hydroxy-4-(4-nitrophenoxy)butyl] decanoate CAS Name: decanoic acid [2-hydroxy-4-(4-nitrophenoxy)butyl] ester IUPAC Name: [2-hydroxy-4-(4-nitrophenoxy)butyl] decanoate Traditional Name: capric acid [2-hydroxy-4-(4-nitrophenoxy)butyl] ester Formula: C20H31NO6 MolecularWeight: 381.46324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OCC(CCOC1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCC(=O)OCC(CCOC1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C20H31NO6/c1-2-3-4-5-6-7-8-9-20(23)27-16-18(22)14-15-26-19-12-10-17(11-13-19)21(24)25/h10-13,18,22H,2-9,14-16H2,1H3