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

Systemtic Name: 4-[4-(4-nitrophenoxy)butyl]-2-oxidanyl-decanoate Openeye Name: 2-hydroxy-4-[4-(4-nitrophenoxy)butyl]decanoate CAS Name: 2-hydroxy-4-[4-(4-nitrophenoxy)butyl]decanoate IUPAC Name: 2-hydroxy-4-[4-(4-nitrophenoxy)butyl]decanoate Traditional Name: 2-hydroxy-4-[4-(4-nitrophenoxy)butyl]caprate Formula: C20H30NO6- MolecularWeight: 380.4553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCOC1=CC=C(C=C1)[N+](=O)[O-])CC(C(=O)[O-])O

Isomeric SMILES

CCCCCCC(CCCCOC1=CC=C(C=C1)[N+](=O)[O-])CC(C(=O)[O-])O

InChI

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