methyl 7-thiophen-3-yl-2,3-dihydro-1-benzoxepine-4-carboxylate

Systemtic Name: methyl 7-thiophen-3-yl-2,3-dihydro-1-benzoxepine-4-carboxylate Openeye Name: methyl 7-(3-thienyl)-2,3-dihydro-1-benzoxepine-4-carboxylate CAS Name: 7-(3-thiophenyl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid methyl ester IUPAC Name: methyl 7-thiophen-3-yl-2,3-dihydro-1-benzoxepine-4-carboxylate Traditional Name: 7-(3-thienyl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid methyl ester Formula: C16H14O3S MolecularWeight: 286.34556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=CC(=C2)C3=CSC=C3)OCC1

Isomeric SMILES

COC(=O)C1=CC2=C(C=CC(=C2)C3=CSC=C3)OCC1

InChI

InChI=1S/C16H14O3S/c1-18-16(17)12-4-6-19-15-3-2-11(8-14(15)9-12)13-5-7-20-10-13/h2-3,5,7-10H,4,6H2,1H3