(4-aminocarbonylphenyl)sulfonyl-[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]azanide

Systemtic Name: (4-aminocarbonylphenyl)sulfonyl-[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]azanide Openeye Name: (4-carbamoylphenyl)sulfonyl-[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]azanide CAS Name: (4-carbamoylphenyl)sulfonyl-[2-(1-pyrrolidin-1-iumylmethyl)phenyl]azanide IUPAC Name: (4-carbamoylphenyl)sulfonyl-[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]azanide Traditional Name: (4-carbamoylphenyl)sulfonyl-[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]azanide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2[N-]S(=O)(=O)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2[N-]S(=O)(=O)C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H20N3O3S/c19-18(22)14-7-9-16(10-8-14)25(23,24)20-17-6-2-1-5-15(17)13-21-11-3-4-12-21/h1-2,5-10H,3-4,11-13H2,(H2,19,22)/q-1/p+1