2-dimethylaminoethyl-[6-ethoxy-2-(4-methoxyphenyl)chromen-4-ylidene]azanium perchlorate

Systemtic Name: 2-dimethylaminoethyl-[6-ethoxy-2-(4-methoxyphenyl)chromen-4-ylidene]azanium perchlorate Openeye Name: 2-dimethylaminoethyl-[6-ethoxy-2-(4-methoxyphenyl)chromen-4-ylidene]ammonium perchlorate CAS Name: 2-dimethylaminoethyl-[6-ethoxy-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]ammonium perchlorate IUPAC Name: 2-dimethylaminoethyl-[6-ethoxy-2-(4-methoxyphenyl)chromen-4-ylidene]azanium perchlorate Traditional Name: 2-dimethylaminoethyl-[6-ethoxy-2-(4-methoxyphenyl)chromen-4-ylidene]ammonium perchlorate Formula: C22H27ClN2O7 MolecularWeight: 466.91198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=CC2=[NH+]CCN(C)C)C3=CC=C(C=C3)OC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC(=CC2=[NH+]CCN(C)C)C3=CC=C(C=C3)OC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H26N2O3.ClHO4/c1-5-26-18-10-11-21-19(14-18)20(23-12-13-24(2)3)15-22(27-21)16-6-8-17(25-4)9-7-16;2-1(3,4)5/h6-11,14-15H,5,12-13H2,1-4H3;(H,2,3,4,5)