2,4-bis(4-butylphenyl)-6-(4-nitrophenyl)pyrylium perchlorate

Systemtic Name: 2,4-bis(4-butylphenyl)-6-(4-nitrophenyl)pyrylium perchlorate Openeye Name: 2,4-bis(4-butylphenyl)-6-(4-nitrophenyl)pyrylium perchlorate CAS Name: 2,4-bis(4-butylphenyl)-6-(4-nitrophenyl)pyrylium perchlorate IUPAC Name: 2,4-bis(4-butylphenyl)-6-(4-nitrophenyl)pyrylium perchlorate Traditional Name: 2,4-bis(4-butylphenyl)-6-(4-nitrophenyl)pyrylium perchlorate Formula: C31H32ClNO7 MolecularWeight: 566.04128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)CCCC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CC(=[O+]C(=C2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)CCCC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C31H32NO3.ClHO4/c1-3-5-7-23-9-13-25(14-10-23)28-21-30(26-15-11-24(12-16-26)8-6-4-2)35-31(22-28)27-17-19-29(20-18-27)32(33)34;2-1(3,4)5/h9-22H,3-8H2,1-2H3;(H,2,3,4,5)/q+1;/p-1