(2-benzamido-2-oxidanylidene-ethyl) 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylate Openeye Name: (2-benzamido-2-oxo-ethyl) 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylate CAS Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylate Traditional Name: 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylic acid (2-benzamido-2-keto-ethyl) ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(S2)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCC2=C(CC1)C=C(S2)C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S/c22-18(21-19(23)14-8-5-3-6-9-14)13-25-20(24)17-12-15-10-4-1-2-7-11-16(15)26-17/h3,5-6,8-9,12H,1-2,4,7,10-11,13H2,(H,21,22,23)