[2-oxidanylidene-2-(prop-2-enylamino)ethyl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylamino)ethyl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: [2-(allylamino)-2-oxo-ethyl] 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid [2-oxo-2-(prop-2-enylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylamino)ethyl] 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid [2-(allylamino)-2-keto-ethyl] ester Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)COC(=O)C1=CC2=C(S1)CCCC2

Isomeric SMILES

C=CCNC(=O)COC(=O)C1=CC2=C(S1)CCCC2

InChI

InChI=1S/C14H17NO3S/c1-2-7-15-13(16)9-18-14(17)12-8-10-5-3-4-6-11(10)19-12/h2,8H,1,3-7,9H2,(H,15,16)