N-(1-propylpiperidin-1-ium-4-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1-propylpiperidin-1-ium-4-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1-propylpiperidin-1-ium-4-yl)-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1-propyl-4-piperidin-1-iumyl)-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1-propylpiperidin-1-ium-4-yl)-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1-propylpiperidin-1-ium-4-yl)-4-pyrrolidinosulfonyl-benzamide Formula: C19H30N3O3S+ MolecularWeight: 380.5248

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H29N3O3S/c1-2-11-21-14-9-17(10-15-21)20-19(23)16-5-7-18(8-6-16)26(24,25)22-12-3-4-13-22/h5-8,17H,2-4,9-15H2,1H3,(H,20,23)/p+1