3-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide

Systemtic Name: 3-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)-4-(1,2,3,4-tetrazol-1-yl)benzenesulfonamide Openeye Name: 3-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)-4-(tetrazol-1-yl)benzenesulfonamide CAS Name: 3-methoxy-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-(1-tetrazolyl)benzenesulfonamide IUPAC Name: 3-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)-4-(tetrazol-1-yl)benzenesulfonamide Traditional Name: 3-methoxy-N-(2-pyrrolidin-1-ium-1-ylethyl)-4-(tetrazol-1-yl)benzenesulfonamide Formula: C14H21N6O3S+ MolecularWeight: 353.41994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)NCC[NH+]2CCCC2)N3C=NN=N3

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)NCC[NH+]2CCCC2)N3C=NN=N3

InChI

InChI=1S/C14H20N6O3S/c1-23-14-10-12(4-5-13(14)20-11-15-17-18-20)24(21,22)16-6-9-19-7-2-3-8-19/h4-5,10-11,16H,2-3,6-9H2,1H3/p+1