ethyl 4-(4-piperazin-1-ylsulfonylphenyl)benzoate

Systemtic Name: ethyl 4-(4-piperazin-1-ylsulfonylphenyl)benzoate Openeye Name: ethyl 4-(4-piperazin-1-ylsulfonylphenyl)benzoate CAS Name: 4-[4-(1-piperazinylsulfonyl)phenyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-piperazin-1-ylsulfonylphenyl)benzoate Traditional Name: 4-(4-piperazinosulfonylphenyl)benzoic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCNCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)N3CCNCC3

InChI

InChI=1S/C19H22N2O4S/c1-2-25-19(22)17-5-3-15(4-6-17)16-7-9-18(10-8-16)26(23,24)21-13-11-20-12-14-21/h3-10,20H,2,11-14H2,1H3