4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl 3,4,5-trimethoxybenzoate

Systemtic Name: 4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl 3,4,5-trimethoxybenzoate Openeye Name: 4,5,6,7-tetrahydrobenzothiophen-2-ylmethyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl ester IUPAC Name: 4,5,6,7-tetrahydro-1-benzothiophen-2-ylmethyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4,5,6,7-tetrahydrobenzothiophen-2-ylmethyl ester Formula: C19H22O5S MolecularWeight: 362.43998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC2=CC3=C(S2)CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC2=CC3=C(S2)CCCC3

InChI

InChI=1S/C19H22O5S/c1-21-15-9-13(10-16(22-2)18(15)23-3)19(20)24-11-14-8-12-6-4-5-7-17(12)25-14/h8-10H,4-7,11H2,1-3H3