4-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Openeye Name: N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-[[(E)-styryl]sulfonylamino]benzamide CAS Name: 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzamide IUPAC Name: 4-[[(E)-2-phenylethenyl]sulfonylamino]-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Traditional Name: N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-[[(E)-styryl]sulfonylamino]benzamide Formula: C22H28N3O3S+ MolecularWeight: 414.54102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c26-22(23-14-6-17-25-15-4-5-16-25)20-9-11-21(12-10-20)24-29(27,28)18-13-19-7-2-1-3-8-19/h1-3,7-13,18,24H,4-6,14-17H2,(H,23,26)/p+1/b18-13+