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methyl 7-methoxy-2,3-dihydro-1-benzothiepine-4-carboxylate

methyl 7-methoxy-2,3-dihydro-1-benzothiepine-4-carboxylate

Systemtic Name:methyl 7-methoxy-2,3-dihydro-1-benzothiepine-4-carboxylate
Openeye Name:methyl 7-methoxy-2,3-dihydro-1-benzothiepine-4-carboxylate
CAS Name:7-methoxy-2,3-dihydro-1-benzothiepin-4-carboxylic acid methyl ester
IUPAC Name:methyl 7-methoxy-2,3-dihydro-1-benzothiepine-4-carboxylate
Traditional Name:7-methoxy-2,3-dihydro-1-benzothiepin-4-carboxylic acid methyl ester
Formula: C13H14O3S
MolecularWeight: 250.31346
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SCCC(=C2)C(=O)OC


Isomeric SMILES

COC1=CC2=C(C=C1)SCCC(=C2)C(=O)OC


InChI

InChI=1S/C13H14O3S/c1-15-11-3-4-12-10(8-11)7-9(5-6-17-12)13(14)16-2/h3-4,7-8H,5-6H2,1-2H3


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