1,3-benzodioxol-5-yl 3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid 1,3-benzodioxol-5-yl ester Formula: C17H12O4S MolecularWeight: 312.33978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)OC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)OC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H12O4S/c1-10-12-4-2-3-5-15(12)22-16(10)17(18)21-11-6-7-13-14(8-11)20-9-19-13/h2-8H,9H2,1H3