ethyl 2-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate

Systemtic Name: ethyl 2-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Openeye Name: ethyl 2-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-(3-chlorophenyl)sulfonylpiperazino]methyl]furan-3-carboxylic acid ethyl ester Formula: C18H21ClN2O5S MolecularWeight: 412.88774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(OC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H21ClN2O5S/c1-2-25-18(22)16-6-11-26-17(16)13-20-7-9-21(10-8-20)27(23,24)15-5-3-4-14(19)12-15/h3-6,11-12H,2,7-10,13H2,1H3