4-chloranyl-3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-chloranyl-3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-chloro-3-(1-piperidylsulfonyl)-N-(1-propylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)-N-(1-propyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-chloro-3-piperidin-1-ylsulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide Traditional Name: 4-chloro-3-piperidinosulfonyl-N-(1-propylpiperidin-1-ium-4-yl)benzamide Formula: C20H31ClN3O3S+ MolecularWeight: 428.99644

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H30ClN3O3S/c1-2-10-23-13-8-17(9-14-23)22-20(25)16-6-7-18(21)19(15-16)28(26,27)24-11-4-3-5-12-24/h6-7,15,17H,2-5,8-14H2,1H3,(H,22,25)/p+1