bis[4-[(E)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenyl] carbonate

Systemtic Name: bis[4-[(E)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenyl] carbonate Openeye Name: bis[4-[(E)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenyl] carbonate CAS Name: carbonic acid bis[4-[(E)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenyl] ester IUPAC Name: bis[4-[(E)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenyl] carbonate Traditional Name: carbonic acid bis[4-[(E)-2-(2,2-dimethyl-1,3-benzodithiol-5-yl)prop-1-enyl]phenyl] ester Formula: C37H34O3S4 MolecularWeight: 654.92406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)OC(=O)OC2=CC=C(C=C2)C=C(C)C3=CC4=C(C=C3)SC(S4)(C)C)C5=CC6=C(C=C5)SC(S6)(C)C

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)OC(=O)OC2=CC=C(C=C2)/C=C(/C3=CC4=C(SC(S4)(C)C)C=C3)\C)/C5=CC6=C(SC(S6)(C)C)C=C5

InChI

InChI=1S/C37H34O3S4/c1-23(27-11-17-31-33(21-27)43-36(3,4)41-31)19-25-7-13-29(14-8-25)39-35(38)40-30-15-9-26(10-16-30)20-24(2)28-12-18-32-34(22-28)44-37(5,6)42-32/h7-22H,1-6H3/b23-19+,24-20+