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

Systemtic Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(1-isopropylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide CAS Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(4-bromophenyl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Traditional Name: (2R)-1-brosyl-N-(1-isopropylpiperidin-1-ium-4-yl)pyrrolidine-2-carboxamide Formula: C19H29BrN3O3S+ MolecularWeight: 459.42086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28BrN3O3S/c1-14(2)22-12-9-16(10-13-22)21-19(24)18-4-3-11-23(18)27(25,26)17-7-5-15(20)6-8-17/h5-8,14,16,18H,3-4,9-13H2,1-2H3,(H,21,24)/p+1/t18-/m1/s1