(2S,3R)-2,3-di(morpholin-4-ium-4-yl)-1-phenyl-3-thiophen-2-yl-propan-1-one

Systemtic Name: (2S,3R)-2,3-di(morpholin-4-ium-4-yl)-1-phenyl-3-thiophen-2-yl-propan-1-one Openeye Name: (2S,3R)-2,3-di(morpholin-4-ium-4-yl)-1-phenyl-3-(2-thienyl)propan-1-one CAS Name: (2S,3R)-2,3-bis(4-morpholin-4-iumyl)-1-phenyl-3-thiophen-2-yl-1-propanone IUPAC Name: (2S,3R)-2,3-di(morpholin-4-ium-4-yl)-1-phenyl-3-thiophen-2-ylpropan-1-one Traditional Name: (2S,3R)-2,3-di(morpholin-4-ium-4-yl)-1-phenyl-3-(2-thienyl)propan-1-one Formula: C21H28N2O3S+2 MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(C2=CC=CS2)C(C(=O)C3=CC=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

C1COCC[NH+]1[C@@H](C2=CC=CS2)[C@@H](C(=O)C3=CC=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C21H26N2O3S/c24-21(17-5-2-1-3-6-17)20(23-10-14-26-15-11-23)19(18-7-4-16-27-18)22-8-12-25-13-9-22/h1-7,16,19-20H,8-15H2/p+2/t19-,20-/m0/s1