5-nitro-3,4-dipentyl-benzene-1,2-diolate

Systemtic Name: 5-nitro-3,4-dipentyl-benzene-1,2-diolate Openeye Name: 5-nitro-3,4-dipentyl-benzene-1,2-diolate CAS Name: 5-nitro-3,4-dipentylbenzene-1,2-diolate IUPAC Name: 5-nitro-3,4-dipentylbenzene-1,2-diolate Traditional Name: 3,4-diamyl-5-nitro-benzene-1,2-diolate Formula: C16H23NO4-2 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C=C1[N+](=O)[O-])[O-])[O-])CCCCC

Isomeric SMILES

CCCCCC1=C(C(=C(C=C1[N+](=O)[O-])[O-])[O-])CCCCC

InChI

InChI=1S/C16H25NO4/c1-3-5-7-9-12-13(10-8-6-4-2)16(19)15(18)11-14(12)17(20)21/h11,18-19H,3-10H2,1-2H3/p-2