butyl-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]oxidanium perchlorate

Systemtic Name: butyl-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]oxidanium perchlorate Openeye Name: butyl-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]oxonium perchlorate CAS Name: butyl-[4-(2,6-diphenyl-4-thiopyranylidene)-1-cyclohexa-2,5-dienylidene]oxonium perchlorate IUPAC Name: butyl-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]oxidanium perchlorate Traditional Name: butyl-[4-(2,6-diphenylthiopyran-4-ylidene)cyclohexa-2,5-dien-1-ylidene]oxonium perchlorate Formula: C27H25ClO5S MolecularWeight: 497.0024

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[O+]=C1C=CC(=C2C=C(SC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C=C1.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCC[O+]=C1C=CC(=C2C=C(SC(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C=C1.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C27H25OS.ClHO4/c1-2-3-18-28-25-16-14-21(15-17-25)24-19-26(22-10-6-4-7-11-22)29-27(20-24)23-12-8-5-9-13-23;2-1(3,4)5/h4-17,19-20H,2-3,18H2,1H3;(H,2,3,4,5)/q+1;/p-1