[5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methoxy-phenyl]-morpholin-4-yl-methanone

Systemtic Name: [5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methoxy-phenyl]-morpholin-4-yl-methanone Openeye Name: [5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methoxy-phenyl]-morpholino-methanone CAS Name: [5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]-2-methoxyphenyl]-(4-morpholinyl)methanone IUPAC Name: [5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methoxyphenyl]-morpholin-4-ylmethanone Traditional Name: [5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methoxy-phenyl]-morpholino-methanone Formula: C18H28N3O5S+ MolecularWeight: 398.49702

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCOCC3

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCOCC3

InChI

InChI=1S/C18H27N3O5S/c1-3-19-6-8-21(9-7-19)27(23,24)15-4-5-17(25-2)16(14-15)18(22)20-10-12-26-13-11-20/h4-5,14H,3,6-13H2,1-2H3/p+1