5,5-dimethyl-3-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]imino-cyclohexen-1-olate

Systemtic Name: 5,5-dimethyl-3-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]imino-cyclohexen-1-olate Openeye Name: 5,5-dimethyl-3-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]imino-cyclohexen-1-olate CAS Name: 5,5-dimethyl-3-[(2R)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]imino-1-cyclohexenolate IUPAC Name: 5,5-dimethyl-3-[(2R)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]iminocyclohexen-1-olate Traditional Name: 5,5-dimethyl-3-[(2R)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]imino-cyclohexen-1-olate Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=NCC(C2=CC=CS2)[NH+]3CCOCC3)C1)[O-])C

Isomeric SMILES

CC1(CC(=CC(=NC[C@H](C2=CC=CS2)[NH+]3CCOCC3)C1)[O-])C

InChI

InChI=1S/C18H26N2O2S/c1-18(2)11-14(10-15(21)12-18)19-13-16(17-4-3-9-23-17)20-5-7-22-8-6-20/h3-4,9-10,16,21H,5-8,11-13H2,1-2H3/t16-/m1/s1