(2S,4R)-N-[2-(cyclopropylcarbamoyl)phenyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S,4R)-N-[2-(cyclopropylcarbamoyl)phenyl]-4-oxidanyl-pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S,4R)-N-[2-(cyclopropylcarbamoyl)phenyl]-4-hydroxy-pyrrolidin-1-ium-2-carboxamide CAS Name: (2S,4R)-N-[2-[(cyclopropylamino)-oxomethyl]phenyl]-4-hydroxy-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S,4R)-N-[2-(cyclopropylcarbamoyl)phenyl]-4-hydroxypyrrolidin-1-ium-2-carboxamide Traditional Name: (2S,4R)-N-[2-(cyclopropylcarbamoyl)phenyl]-4-hydroxy-pyrrolidin-1-ium-2-carboxamide Formula: C15H20N3O3+ MolecularWeight: 290.3376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C3CC(C[NH2+]3)O

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)[C@@H]3C[C@H](C[NH2+]3)O

InChI

InChI=1S/C15H19N3O3/c19-10-7-13(16-8-10)15(21)18-12-4-2-1-3-11(12)14(20)17-9-5-6-9/h1-4,9-10,13,16,19H,5-8H2,(H,17,20)(H,18,21)/p+1/t10-,13+/m1/s1