4-ethyl-3-morpholin-4-ylsulfonyl-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 4-ethyl-3-morpholin-4-ylsulfonyl-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 4-ethyl-3-morpholinosulfonyl-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-ethyl-3-(4-morpholinylsulfonyl)-N-[(2S)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-ethyl-3-morpholin-4-ylsulfonyl-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-ethyl-3-morpholinosulfonyl-N-[(2S)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C25H34N3O4S+ MolecularWeight: 472.62016

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NCC(C2=CC=CC=C2)[NH+]3CCCC3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NC[C@H](C2=CC=CC=C2)[NH+]3CCCC3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H33N3O4S/c1-2-20-10-11-22(18-24(20)33(30,31)28-14-16-32-17-15-28)25(29)26-19-23(27-12-6-7-13-27)21-8-4-3-5-9-21/h3-5,8-11,18,23H,2,6-7,12-17,19H2,1H3,(H,26,29)/p+1/t23-/m1/s1