2,6-ditert-butyl-4-[(E)-3-(2,6-ditert-butylselenopyran-1-ium-4-yl)prop-2-enylidene]pyran perchlorate

Systemtic Name: 2,6-ditert-butyl-4-[(E)-3-(2,6-ditert-butylselenopyran-1-ium-4-yl)prop-2-enylidene]pyran perchlorate Openeye Name: 2,6-ditert-butyl-4-[(E)-3-(2,6-ditert-butylselenopyrylium-4-yl)prop-2-enylidene]pyran perchlorate CAS Name: 2,6-ditert-butyl-4-[(E)-3-(2,6-ditert-butyl-4-selenin-1-iumyl)prop-2-enylidene]pyran perchlorate IUPAC Name: 2,6-ditert-butyl-4-[(E)-3-(2,6-ditert-butylselenopyran-1-ium-4-yl)prop-2-enylidene]pyran perchlorate Traditional Name: 2,6-ditert-butyl-4-[(E)-3-(2,6-ditert-butylselenopyrylium-4-yl)prop-2-enylidene]pyran perchlorate Formula: C29H43ClO5Se MolecularWeight: 586.06172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=CC2=CC(=[Se+]C(=C2)C(C)(C)C)C(C)(C)C)C=C(O1)C(C)(C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)(C)C1=CC(=C/C=C/C2=CC(=[Se+]C(=C2)C(C)(C)C)C(C)(C)C)C=C(O1)C(C)(C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C29H43OSe.ClHO4/c1-26(2,3)22-16-20(17-23(30-22)27(4,5)6)14-13-15-21-18-24(28(7,8)9)31-25(19-21)29(10,11)12;2-1(3,4)5/h13-19H,1-12H3;(H,2,3,4,5)/q+1;/p-1/b15-13+;