4-chloranyl-3-piperidin-1-ylsulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 4-chloranyl-3-piperidin-1-ylsulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Openeye Name: 4-chloro-3-(1-piperidylsulfonyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzamide IUPAC Name: 4-chloro-3-piperidin-1-ylsulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Traditional Name: 4-chloro-3-piperidinosulfonyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzamide Formula: C19H29ClN3O3S+ MolecularWeight: 414.96986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC[NH+]3CCCC3)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC[NH+]3CCCC3)Cl

InChI

InChI=1S/C19H28ClN3O3S/c20-17-8-7-16(19(24)21-9-6-12-22-10-4-5-11-22)15-18(17)27(25,26)23-13-2-1-3-14-23/h7-8,15H,1-6,9-14H2,(H,21,24)/p+1