tert-butyl 2-(ethoxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: tert-butyl 2-(ethoxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: tert-butyl 2-(ethoxycarbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-(ethoxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(ethoxycarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-(carbethoxyamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid tert-butyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H23NO4S/c1-5-20-15(19)17-13-12(14(18)21-16(2,3)4)10-8-6-7-9-11(10)22-13/h5-9H2,1-4H3,(H,17,19)