(2R)-1-(5-chloranylthiophen-2-yl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(5-chloranylthiophen-2-yl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Openeye Name: (2R)-1-[(5-chloro-2-thienyl)sulfonyl]-N-(1-isopropylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide CAS Name: (2R)-1-[(5-chloro-2-thiophenyl)sulfonyl]-N-(1-propan-2-yl-4-piperidin-1-iumyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(5-chlorothiophen-2-yl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Traditional Name: (2R)-1-[(5-chloro-2-thienyl)sulfonyl]-N-(1-isopropylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Formula: C17H27ClN3O3S2+ MolecularWeight: 420.99758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)NC(=O)[C@H]2CCCN2S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H26ClN3O3S2/c1-12(2)20-10-7-13(8-11-20)19-17(22)14-4-3-9-21(14)26(23,24)16-6-5-15(18)25-16/h5-6,12-14H,3-4,7-11H2,1-2H3,(H,19,22)/p+1/t14-/m1/s1