[2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-cyclododecyl-azanium perchlorate

Systemtic Name: [2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-cyclododecyl-azanium perchlorate Openeye Name: [2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-cyclododecyl-ammonium perchlorate CAS Name: [2-(4-chlorophenyl)-6-ethoxy-1-benzopyran-4-ylidene]-cyclododecylammonium perchlorate IUPAC Name: [2-(4-chlorophenyl)-6-ethoxychromen-4-ylidene]-cyclododecylazanium perchlorate Traditional Name: [2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-cyclododecyl-ammonium perchlorate Formula: C29H37Cl2NO6 MolecularWeight: 566.51318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=CC2=[NH+]C3CCCCCCCCCCC3)C4=CC=C(C=C4)Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=CC2=[NH+]C3CCCCCCCCCCC3)C4=CC=C(C=C4)Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C29H36ClNO2.ClHO4/c1-2-32-25-18-19-28-26(20-25)27(21-29(33-28)22-14-16-23(30)17-15-22)31-24-12-10-8-6-4-3-5-7-9-11-13-24;2-1(3,4)5/h14-21,24H,2-13H2,1H3;(H,2,3,4,5)