(2-oxidanylidene-2-phenylazanyl-ethyl) 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate CAS Name: 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylate Traditional Name: 5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3S/c20-17(19-14-8-4-2-5-9-14)12-22-18(21)16-11-13-7-3-1-6-10-15(13)23-16/h2,4-5,8-9,11H,1,3,6-7,10,12H2,(H,19,20)