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

Systemtic Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-morpholinosulfonyl-benzamide CAS Name: N-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-morpholinosulfonyl-benzamide Formula: C23H30N3O5S+ MolecularWeight: 460.5664

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1COCC[NH+]1C[C@H](C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H29N3O5S/c27-23(20-7-4-8-21(17-20)32(28,29)26-11-15-31-16-12-26)24-22(19-5-2-1-3-6-19)18-25-9-13-30-14-10-25/h1-8,17,22H,9-16,18H2,(H,24,27)/p+1/t22-/m1/s1