(2S,3S)-3-ethylpyrrolidine-2-carboxamide hydrate

Systemtic Name: (2S,3S)-3-ethylpyrrolidine-2-carboxamide hydrate Openeye Name: (2S,3S)-3-ethylpyrrolidine-2-carboxamide hydrate CAS Name: (2S,3S)-3-ethyl-2-pyrrolidinecarboxamide hydrate IUPAC Name: (2S,3S)-3-ethylpyrrolidine-2-carboxamide hydrate Traditional Name: (2S,3S)-3-ethylpyrrolidine-2-carboxamide hydrate Formula: C7H16N2O2 MolecularWeight: 160.21414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCNC1C(=O)N.O

Isomeric SMILES

CC[C@H]1CCN[C@@H]1C(=O)N.O

InChI

InChI=1S/C7H14N2O.H2O/c1-2-5-3-4-9-6(5)7(8)10;/h5-6,9H,2-4H2,1H3,(H2,8,10);1H2/t5-,6-;/m0./s1