(3-morpholin-4-ylsulfonylphenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3-morpholinosulfonylphenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone CAS Name: [3-(4-morpholinylsulfonyl)phenyl]-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3-morpholinosulfonylphenyl)-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Formula: C23H30N3O5S+ MolecularWeight: 460.5664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H29N3O5S/c27-23(20-5-4-8-22(19-20)32(28,29)26-14-16-30-17-15-26)25-11-9-24(10-12-25)13-18-31-21-6-2-1-3-7-21/h1-8,19H,9-18H2/p+1