(2S,4R)-N-(2,3-dihydro-1H-inden-5-yl)-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-N-(2,3-dihydro-1H-inden-5-yl)-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-4-hydroxy-N-indan-5-yl-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-N-(2,3-dihydro-1H-inden-5-yl)-4-hydroxy-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-N-(2,3-dihydro-1H-inden-5-yl)-4-hydroxypyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-4-hydroxy-N-indan-5-yl-pyrrolidin-1-ium-2-carboxamide Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)C3CC(C[NH2+]3)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)[C@@H]3C[C@H](C[NH2+]3)O

InChI

InChI=1S/C14H18N2O2/c17-12-7-13(15-8-12)14(18)16-11-5-4-9-2-1-3-10(9)6-11/h4-6,12-13,15,17H,1-3,7-8H2,(H,16,18)/p+1/t12-,13+/m1/s1