[2-(3-methoxy-4-oxidanyl-phenyl)chromen-4-ylidene]-(oxolan-2-ylmethyl)azanium perchlorate

Systemtic Name: [2-(3-methoxy-4-oxidanyl-phenyl)chromen-4-ylidene]-(oxolan-2-ylmethyl)azanium perchlorate Openeye Name: [2-(4-hydroxy-3-methoxy-phenyl)chromen-4-ylidene]-(tetrahydrofuran-2-ylmethyl)ammonium perchlorate CAS Name: [2-(4-hydroxy-3-methoxyphenyl)-1-benzopyran-4-ylidene]-(2-oxolanylmethyl)ammonium perchlorate IUPAC Name: [2-(4-hydroxy-3-methoxyphenyl)chromen-4-ylidene]-(oxolan-2-ylmethyl)azanium perchlorate Traditional Name: [2-(4-hydroxy-3-methoxy-phenyl)chromen-4-ylidene]-(tetrahydrofurfuryl)ammonium perchlorate Formula: C21H22ClNO8 MolecularWeight: 451.85428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=CC(=[NH+]CC3CCCO3)C4=CC=CC=C4O2)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=C(C=CC(=C1)C2=CC(=[NH+]CC3CCCO3)C4=CC=CC=C4O2)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H21NO4.ClHO4/c1-24-21-11-14(8-9-18(21)23)20-12-17(22-13-15-5-4-10-25-15)16-6-2-3-7-19(16)26-20;2-1(3,4)5/h2-3,6-9,11-12,15,23H,4-5,10,13H2,1H3;(H,2,3,4,5)