ethyl 4-[4-[(3-chloranylphenoxy)methyl]thiophen-2-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(3-chloranylphenoxy)methyl]thiophen-2-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(3-chlorophenoxy)methyl]thiophene-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(3-chlorophenoxy)methyl]-2-thiophenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(3-chlorophenoxy)methyl]thiophene-2-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(3-chlorophenoxy)methyl]thiophene-2-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H21ClN2O4S MolecularWeight: 408.89904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CS2)COC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CS2)COC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H21ClN2O4S/c1-2-25-19(24)22-8-6-21(7-9-22)18(23)17-10-14(13-27-17)12-26-16-5-3-4-15(20)11-16/h3-5,10-11,13H,2,6-9,12H2,1H3