(2-chloranyl-3-methanoyl-4-nitro-phenoxy)-cyclohexyl-oxidanyl-(4-propyloctanoyl)azanium

Systemtic Name: (2-chloranyl-3-methanoyl-4-nitro-phenoxy)-cyclohexyl-oxidanyl-(4-propyloctanoyl)azanium Openeye Name: (2-chloro-3-formyl-4-nitro-phenoxy)-cyclohexyl-hydroxy-(4-propyloctanoyl)ammonium CAS Name: (2-chloro-3-formyl-4-nitrophenoxy)-cyclohexyl-hydroxy-(1-oxo-4-propyloctyl)ammonium IUPAC Name: (2-chloro-3-formyl-4-nitrophenoxy)-cyclohexyl-hydroxy-(4-propyloctanoyl)azanium Traditional Name: (2-chloro-3-formyl-4-nitro-phenoxy)-cyclohexyl-hydroxy-(4-propyloctanoyl)ammonium Formula: C24H36ClN2O6+ MolecularWeight: 484.00544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)CCC(=O)[N+](C1CCCCC1)(O)OC2=C(C(=C(C=C2)[N+](=O)[O-])C=O)Cl

Isomeric SMILES

CCCCC(CCC)CCC(=O)[N+](C1CCCCC1)(O)OC2=C(C(=C(C=C2)[N+](=O)[O-])C=O)Cl

InChI

InChI=1S/C24H36ClN2O6/c1-3-5-10-18(9-4-2)13-16-23(29)27(32,19-11-7-6-8-12-19)33-22-15-14-21(26(30)31)20(17-28)24(22)25/h14-15,17-19,32H,3-13,16H2,1-2H3/q+1