7-thiophen-3-yl-2,3-dihydro-1-benzoxepine-4-carboxylic acid

Systemtic Name: 7-thiophen-3-yl-2,3-dihydro-1-benzoxepine-4-carboxylic acid Openeye Name: 7-(3-thienyl)-2,3-dihydro-1-benzoxepine-4-carboxylic acid CAS Name: 7-(3-thiophenyl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid IUPAC Name: 7-thiophen-3-yl-2,3-dihydro-1-benzoxepine-4-carboxylic acid Traditional Name: 7-(3-thienyl)-2,3-dihydro-1-benzoxepin-4-carboxylic acid Formula: C15H12O3S MolecularWeight: 272.31898

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C1C(=O)O)C=C(C=C2)C3=CSC=C3

Isomeric SMILES

C1COC2=C(C=C1C(=O)O)C=C(C=C2)C3=CSC=C3

InChI

InChI=1S/C15H12O3S/c16-15(17)11-3-5-18-14-2-1-10(7-13(14)8-11)12-4-6-19-9-12/h1-2,4,6-9H,3,5H2,(H,16,17)