butyl 2-azanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: butyl 2-azanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: butyl 2-amino-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid butyl ester IUPAC Name: butyl 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-amino-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid butyl ester Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(SC2=C1CCCC2)N

Isomeric SMILES

CCCCOC(=O)C1=C(SC2=C1CCCC2)N

InChI

InChI=1S/C13H19NO2S/c1-2-3-8-16-13(15)11-9-6-4-5-7-10(9)17-12(11)14/h2-8,14H2,1H3