N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-4-phenoxy-benzamide

Systemtic Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-yl-ethyl]-4-phenoxy-benzamide Openeye Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-4-phenoxy-benzamide CAS Name: N-[(2S)-2-(4-morpholin-4-iumyl)-2-thiophen-2-ylethyl]-4-phenoxybenzamide IUPAC Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-thiophen-2-ylethyl]-4-phenoxybenzamide Traditional Name: N-[(2S)-2-morpholin-4-ium-4-yl-2-(2-thienyl)ethyl]-4-phenoxy-benzamide Formula: C23H25N2O3S+ MolecularWeight: 409.5212

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H24N2O3S/c26-23(18-8-10-20(11-9-18)28-19-5-2-1-3-6-19)24-17-21(22-7-4-16-29-22)25-12-14-27-15-13-25/h1-11,16,21H,12-15,17H2,(H,24,26)/p+1/t21-/m0/s1