phenyl 4-[(4,5-dimethyl-1,3-dithiol-2-ylidene)methyl]benzoate

Systemtic Name: phenyl 4-[(4,5-dimethyl-1,3-dithiol-2-ylidene)methyl]benzoate Openeye Name: phenyl 4-[(4,5-dimethyl-1,3-dithiol-2-ylidene)methyl]benzoate CAS Name: 4-[(4,5-dimethyl-1,3-dithiol-2-ylidene)methyl]benzoic acid phenyl ester IUPAC Name: phenyl 4-[(4,5-dimethyl-1,3-dithiol-2-ylidene)methyl]benzoate Traditional Name: 4-[(4,5-dimethyl-1,3-dithiol-2-ylidene)methyl]benzoic acid phenyl ester Formula: C19H16O2S2 MolecularWeight: 340.45914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=CC2=CC=C(C=C2)C(=O)OC3=CC=CC=C3)S1)C

Isomeric SMILES

CC1=C(SC(=CC2=CC=C(C=C2)C(=O)OC3=CC=CC=C3)S1)C

InChI

InChI=1S/C19H16O2S2/c1-13-14(2)23-18(22-13)12-15-8-10-16(11-9-15)19(20)21-17-6-4-3-5-7-17/h3-12H,1-2H3