(2S)-N-phenyl-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)propanamide

Systemtic Name: (2S)-N-phenyl-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)propanamide Openeye Name: (2S)-N-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]propanamide CAS Name: (2S)-2-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidin-1-iumyl]-N-phenylpropanamide IUPAC Name: (2S)-N-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-phenyl-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]propionamide Formula: C19H28N3O2+ MolecularWeight: 330.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)N3CCCC3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)[NH+]2CCC(CC2)C(=O)N3CCCC3

InChI

InChI=1S/C19H27N3O2/c1-15(18(23)20-17-7-3-2-4-8-17)21-13-9-16(10-14-21)19(24)22-11-5-6-12-22/h2-4,7-8,15-16H,5-6,9-14H2,1H3,(H,20,23)/p+1/t15-/m0/s1