2-chloranyl-N-(3-morpholin-4-ium-4-ylpropyl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(3-morpholin-4-ium-4-ylpropyl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[3-(4-morpholin-4-iumyl)propyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(3-morpholin-4-ium-4-ylpropyl)-5-piperidinosulfonyl-benzamide Formula: C19H29ClN3O4S+ MolecularWeight: 430.96926

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C19H28ClN3O4S/c20-18-6-5-16(28(25,26)23-9-2-1-3-10-23)15-17(18)19(24)21-7-4-8-22-11-13-27-14-12-22/h5-6,15H,1-4,7-14H2,(H,21,24)/p+1