1-(diphenylmethyl)-N-[2-(4-sulfamoylphenyl)ethyl]azetidin-1-ium-3-carboxamide

Systemtic Name: 1-(diphenylmethyl)-N-[2-(4-sulfamoylphenyl)ethyl]azetidin-1-ium-3-carboxamide Openeye Name: 1-benzhydryl-N-[2-(4-sulfamoylphenyl)ethyl]azetidin-1-ium-3-carboxamide CAS Name: 1-(diphenylmethyl)-N-[2-(4-sulfamoylphenyl)ethyl]-3-azetidin-1-iumcarboxamide IUPAC Name: 1-benzhydryl-N-[2-(4-sulfamoylphenyl)ethyl]azetidin-1-ium-3-carboxamide Traditional Name: 1-benzhydryl-N-[2-(4-sulfamoylphenyl)ethyl]azetidin-1-ium-3-carboxamide Formula: C25H28N3O3S+ MolecularWeight: 450.57312

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1C(C[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C25H27N3O3S/c26-32(30,31)23-13-11-19(12-14-23)15-16-27-25(29)22-17-28(18-22)24(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-14,22,24H,15-18H2,(H,27,29)(H2,26,30,31)/p+1