(2R)-2-piperidin-1-ium-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: (2R)-2-piperidin-1-ium-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2R)-2-piperidin-1-ium-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: (2R)-2-(1-piperidin-1-iumyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: (2R)-2-piperidin-1-ium-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2R)-2-piperidin-1-ium-1-yl-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C18H28N3O3S+ MolecularWeight: 366.49822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+]3CCCCC3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C18H27N3O3S/c1-15(20-11-3-2-4-12-20)18(22)19-16-7-9-17(10-8-16)25(23,24)21-13-5-6-14-21/h7-10,15H,2-6,11-14H2,1H3,(H,19,22)/p+1/t15-/m1/s1