[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] benzoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] benzoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] benzoate CAS Name: benzoic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] benzoate Traditional Name: benzoic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C17H16O3S2 MolecularWeight: 332.43714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C2SCCS2)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16O3S2/c1-19-15-11-13(17-21-9-10-22-17)7-8-14(15)20-16(18)12-5-3-2-4-6-12/h2-8,11,17H,9-10H2,1H3