[2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-(3-oxidanylpropyl)azanium perchlorate

Systemtic Name: [2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-(3-oxidanylpropyl)azanium perchlorate Openeye Name: [2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-(3-hydroxypropyl)ammonium perchlorate CAS Name: [2-(4-chlorophenyl)-6-ethoxy-1-benzopyran-4-ylidene]-(3-hydroxypropyl)ammonium perchlorate IUPAC Name: [2-(4-chlorophenyl)-6-ethoxychromen-4-ylidene]-(3-hydroxypropyl)azanium perchlorate Traditional Name: [2-(4-chlorophenyl)-6-ethoxy-chromen-4-ylidene]-(3-hydroxypropyl)ammonium perchlorate Formula: C20H21Cl2NO7 MolecularWeight: 458.28924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20ClNO3.ClHO4/c1-2-24-16-8-9-19-17(12-16)18(22-10-3-11-23)13-20(25-19)14-4-6-15(21)7-5-14;2-1(3,4)5/h4-9,12-13,23H,2-3,10-11H2,1H3;(H,2,3,4,5)