(2R,4R)-N-[3-[methyl(phenyl)amino]propyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2R,4R)-N-[3-[methyl(phenyl)amino]propyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2R,4R)-4-hydroxy-N-[3-(N-methylanilino)propyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2R,4R)-4-hydroxy-N-[3-(N-methylanilino)propyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2R,4R)-4-hydroxy-N-[3-(N-methylanilino)propyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2R,4R)-4-hydroxy-N-[3-(N-methylanilino)propyl]pyrrolidin-1-ium-2-carboxamide Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CC(C[NH2+]1)O)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)[C@H]1C[C@H](C[NH2+]1)O)C2=CC=CC=C2

InChI

InChI=1S/C15H23N3O2/c1-18(12-6-3-2-4-7-12)9-5-8-16-15(20)14-10-13(19)11-17-14/h2-4,6-7,13-14,17,19H,5,8-11H2,1H3,(H,16,20)/p+1/t13-,14-/m1/s1