N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-4-piperidinosulfonyl-benzamide Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H29N3O3S/c1-2-21-12-6-7-17(21)15-20-19(23)16-8-10-18(11-9-16)26(24,25)22-13-4-3-5-14-22/h8-11,17H,2-7,12-15H2,1H3,(H,20,23)/p+1/t17-/m1/s1