ethyl 4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(4,5,6,7-tetrahydrobenzothiophene-3-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CSC3=C2CCCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CSC3=C2CCCC3

InChI

InChI=1S/C16H22N2O3S/c1-2-21-16(20)18-9-7-17(8-10-18)15(19)13-11-22-14-6-4-3-5-12(13)14/h11H,2-10H2,1H3