(2S)-1-[2-methoxy-6-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-3-morpholin-4-ium-4-yl-propan-2-ol

Systemtic Name: (2S)-1-[2-methoxy-6-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-3-morpholin-4-ium-4-yl-propan-2-ol Openeye Name: (2S)-1-[2-methoxy-6-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-3-morpholin-4-ium-4-yl-propan-2-ol CAS Name: (2S)-1-[2-methoxy-6-(4-thiomorpholin-4-iumylmethyl)phenoxy]-3-(4-morpholin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-[2-methoxy-6-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-3-morpholin-4-ium-4-ylpropan-2-ol Traditional Name: (2S)-1-[2-methoxy-6-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-3-morpholin-4-ium-4-yl-propan-2-ol Formula: C19H32N2O4S+2 MolecularWeight: 384.53338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC(C[NH+]2CCOCC2)O)C[NH+]3CCSCC3

Isomeric SMILES

COC1=CC=CC(=C1OC[C@H](C[NH+]2CCOCC2)O)C[NH+]3CCSCC3

InChI

InChI=1S/C19H30N2O4S/c1-23-18-4-2-3-16(13-21-7-11-26-12-8-21)19(18)25-15-17(22)14-20-5-9-24-10-6-20/h2-4,17,22H,5-15H2,1H3/p+2/t17-/m0/s1