1-(2-butyl-4-phenyl-phenyl)-2,3-dinitro-benzene

Systemtic Name: 1-(2-butyl-4-phenyl-phenyl)-2,3-dinitro-benzene Openeye Name: 1-(2-butyl-4-phenyl-phenyl)-2,3-dinitro-benzene CAS Name: 1-(2-butyl-4-phenylphenyl)-2,3-dinitrobenzene IUPAC Name: 1-(2-butyl-4-phenylphenyl)-2,3-dinitrobenzene Traditional Name: 1-(2-butyl-4-phenyl-phenyl)-2,3-dinitro-benzene Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)C2=CC=CC=C2)C3=C(C(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCC1=C(C=CC(=C1)C2=CC=CC=C2)C3=C(C(=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O4/c1-2-3-8-18-15-17(16-9-5-4-6-10-16)13-14-19(18)20-11-7-12-21(23(25)26)22(20)24(27)28/h4-7,9-15H,2-3,8H2,1H3