ethyl 4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: ethyl 4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)sulfonylbenzoate Openeye Name: ethyl 4-[4-(piperidine-1-carbonyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(piperidine-1-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(piperidine-1-carbonyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C19H27N3O5S/c1-2-27-18(23)16-6-8-17(9-7-16)28(25,26)22-14-12-21(13-15-22)19(24)20-10-4-3-5-11-20/h6-9H,2-5,10-15H2,1H3