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

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxylate Openeye Name: (2-amino-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-amino-2-oxoethyl) ester IUPAC Name: (2-amino-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-amino-2-keto-ethyl) ester Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(S2)C(=O)OCC(=O)N

Isomeric SMILES

C1CCCC2=C(CC1)C=C(S2)C(=O)OCC(=O)N

InChI

InChI=1S/C13H17NO3S/c14-12(15)8-17-13(16)11-7-9-5-3-1-2-4-6-10(9)18-11/h7H,1-6,8H2,(H2,14,15)