(E)-(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)-(6-oxidanyl-2-phenyl-chromen-4-ylidene)azanium perchlorate

Systemtic Name: (E)-(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)-(6-oxidanyl-2-phenyl-chromen-4-ylidene)azanium perchlorate Openeye Name: (E)-(5-ethoxycarbonyl-4-methyl-thiazol-2-yl)-(6-hydroxy-2-phenyl-chromen-4-ylidene)ammonium perchlorate CAS Name: (E)-(5-ethoxycarbonyl-4-methyl-2-thiazolyl)-(6-hydroxy-2-phenyl-1-benzopyran-4-ylidene)ammonium perchlorate IUPAC Name: (E)-(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)-(6-hydroxy-2-phenylchromen-4-ylidene)azanium perchlorate Traditional Name: (E)-(5-carbethoxy-4-methyl-thiazol-2-yl)-(6-hydroxy-2-phenyl-chromen-4-ylidene)ammonium perchlorate Formula: C22H19ClN2O8S MolecularWeight: 506.91286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)[NH+]=C2C=C(OC3=C2C=C(C=C3)O)C4=CC=CC=C4)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)/[NH+]=C/2\C=C(OC3=C2C=C(C=C3)O)C4=CC=CC=C4)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H18N2O4S.ClHO4/c1-3-27-21(26)20-13(2)23-22(29-20)24-17-12-19(14-7-5-4-6-8-14)28-18-10-9-15(25)11-16(17)18;2-1(3,4)5/h4-12,25H,3H2,1-2H3;(H,2,3,4,5)/b24-17+;