[2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]-(pyridin-3-ylmethyl)azanium perchlorate

Systemtic Name: [2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]-(pyridin-3-ylmethyl)azanium perchlorate Openeye Name: [2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]-(3-pyridylmethyl)ammonium perchlorate CAS Name: [2-(4-chlorophenyl)-6-methyl-1-benzopyran-4-ylidene]-(3-pyridinylmethyl)ammonium perchlorate IUPAC Name: [2-(4-chlorophenyl)-6-methylchromen-4-ylidene]-(pyridin-3-ylmethyl)azanium perchlorate Traditional Name: [2-(4-chlorophenyl)-6-methyl-chromen-4-ylidene]-(3-pyridylmethyl)ammonium perchlorate Formula: C22H18Cl2N2O5 MolecularWeight: 461.29472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=[NH+]CC3=CN=CC=C3)C4=CC=C(C=C4)Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=CC2=[NH+]CC3=CN=CC=C3)C4=CC=C(C=C4)Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H17ClN2O.ClHO4/c1-15-4-9-21-19(11-15)20(25-14-16-3-2-10-24-13-16)12-22(26-21)17-5-7-18(23)8-6-17;2-1(3,4)5/h2-13H,14H2,1H3;(H,2,3,4,5)