potassium (Z)-[5-(2-hexyldecanoylamino)-1,3-bis(oxidanylidene)inden-2-ylidene]methanethiolate

Systemtic Name: potassium (Z)-[5-(2-hexyldecanoylamino)-1,3-bis(oxidanylidene)inden-2-ylidene]methanethiolate Openeye Name: potassium (Z)-[5-(2-hexyldecanoylamino)-1,3-dioxo-indan-2-ylidene]methanethiolate CAS Name: potassium (Z)-[5-[(2-hexyl-1-oxodecyl)amino]-1,3-dioxo-2-indenylidene]methanethiolate IUPAC Name: potassium (Z)-[5-(2-hexyldecanoylamino)-1,3-dioxoinden-2-ylidene]methanethiolate Traditional Name: potassium (Z)-[5-(2-hexyldecanoylamino)-1,3-diketo-indan-2-ylidene]methanethiolate Formula: C26H36KNO3S MolecularWeight: 481.73224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCC)C(=O)NC1=CC2=C(C=C1)C(=O)C(=C[S-])C2=O.[K+]

Isomeric SMILES

CCCCCCCCC(CCCCCC)C(=O)NC1=CC2=C(C=C1)C(=O)/C(=C/[S-])/C2=O.[K+]

InChI

InChI=1S/C26H37NO3S.K/c1-3-5-7-9-10-12-14-19(13-11-8-6-4-2)26(30)27-20-15-16-21-22(17-20)25(29)23(18-31)24(21)28;/h15-19,31H,3-14H2,1-2H3,(H,27,30);/q;+1/p-1/b23-18-;