tris(5-methyl-3,5-dihydro-2H-1,4-dithiepin-6-yl) phosphate

Systemtic Name: tris(5-methyl-3,5-dihydro-2H-1,4-dithiepin-6-yl) phosphate Openeye Name: tris(5-methyl-3,5-dihydro-2H-1,4-dithiepin-6-yl) phosphate CAS Name: phosphoric acid tris(5-methyl-3,5-dihydro-2H-1,4-dithiepin-6-yl) ester IUPAC Name: tris(5-methyl-3,5-dihydro-2H-1,4-dithiepin-6-yl) phosphate Traditional Name: phosphoric acid tris(5-methyl-3,5-dihydro-2H-1,4-dithiepin-6-yl) ester Formula: C18H27O4PS6 MolecularWeight: 530.768341

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CSCCS1)OP(=O)(OC2=CSCCSC2C)OC3=CSCCSC3C

Isomeric SMILES

CC1C(=CSCCS1)OP(=O)(OC2=CSCCSC2C)OC3=CSCCSC3C

InChI

InChI=1S/C18H27O4PS6/c1-13-16(10-24-4-7-27-13)20-23(19,21-17-11-25-5-8-28-14(17)2)22-18-12-26-6-9-29-15(18)3/h10-15H,4-9H2,1-3H3