(E)-1,3-benzothiazol-2-yl-[2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]azanium perchlorate

Systemtic Name: (E)-1,3-benzothiazol-2-yl-[2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]azanium perchlorate Openeye Name: (E)-1,3-benzothiazol-2-yl-[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]ammonium perchlorate CAS Name: (E)-1,3-benzothiazol-2-yl-[6-hydroxy-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]ammonium perchlorate IUPAC Name: (E)-1,3-benzothiazol-2-yl-[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]azanium perchlorate Traditional Name: (E)-1,3-benzothiazol-2-yl-[6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]ammonium perchlorate Formula: C23H17ClN2O7S MolecularWeight: 500.90828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=[NH+]C3=NC4=CC=CC=C4S3)C5=C(O2)C=CC(=C5)O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C/C(=[NH+]\C3=NC4=CC=CC=C4S3)/C5=C(O2)C=CC(=C5)O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C23H16N2O3S.ClHO4/c1-27-16-9-6-14(7-10-16)21-13-19(17-12-15(26)8-11-20(17)28-21)25-23-24-18-4-2-3-5-22(18)29-23;2-1(3,4)5/h2-13,26H,1H3;(H,2,3,4,5)/b25-19+;