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

Systemtic Name: [2-(4-chlorophenyl)-6-methoxy-chromen-4-ylidene]-cyclododecyl-azanium perchlorate Openeye Name: [2-(4-chlorophenyl)-6-methoxy-chromen-4-ylidene]-cyclododecyl-ammonium perchlorate CAS Name: [2-(4-chlorophenyl)-6-methoxy-1-benzopyran-4-ylidene]-cyclododecylammonium perchlorate IUPAC Name: [2-(4-chlorophenyl)-6-methoxychromen-4-ylidene]-cyclododecylazanium perchlorate Traditional Name: [2-(4-chlorophenyl)-6-methoxy-chromen-4-ylidene]-cyclododecyl-ammonium perchlorate Formula: C28H35Cl2NO6 MolecularWeight: 552.4866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=CC2=[NH+]C3CCCCCCCCCCC3)C4=CC=C(C=C4)Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=CC2=[NH+]C3CCCCCCCCCCC3)C4=CC=C(C=C4)Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H34ClNO2.ClHO4/c1-31-24-17-18-27-25(19-24)26(20-28(32-27)21-13-15-22(29)16-14-21)30-23-11-9-7-5-3-2-4-6-8-10-12-23;2-1(3,4)5/h13-20,23H,2-12H2,1H3;(H,2,3,4,5)