2-nitro-4-[3-(3-nitro-4-oxidanyl-5-propan-2-yl-phenyl)pentan-3-yl]-6-propan-2-yl-phenol

Systemtic Name: 2-nitro-4-[3-(3-nitro-4-oxidanyl-5-propan-2-yl-phenyl)pentan-3-yl]-6-propan-2-yl-phenol Openeye Name: 4-[1-ethyl-1-(4-hydroxy-3-isopropyl-5-nitro-phenyl)propyl]-2-isopropyl-6-nitro-phenol CAS Name: 4-[3-(4-hydroxy-3-nitro-5-propan-2-ylphenyl)pentan-3-yl]-2-nitro-6-propan-2-ylphenol IUPAC Name: 4-[3-(4-hydroxy-3-nitro-5-propan-2-ylphenyl)pentan-3-yl]-2-nitro-6-propan-2-ylphenol Traditional Name: 4-[1-ethyl-1-(4-hydroxy-3-isopropyl-5-nitro-phenyl)propyl]-2-isopropyl-6-nitro-phenol Formula: C23H30N2O6 MolecularWeight: 430.4941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O6/c1-7-23(8-2,15-9-17(13(3)4)21(26)19(11-15)24(28)29)16-10-18(14(5)6)22(27)20(12-16)25(30)31/h9-14,26-27H,7-8H2,1-6H3