(2S)-2-[[(2S)-1-(2-azaniumylethanoyl)pyrrolidin-2-yl]carbonylamino]pent-4-ynoate

Systemtic Name: (2S)-2-[[(2S)-1-(2-azaniumylethanoyl)pyrrolidin-2-yl]carbonylamino]pent-4-ynoate Openeye Name: (2S)-2-[[(2S)-1-(2-azaniumylacetyl)pyrrolidine-2-carbonyl]amino]pent-4-ynoate CAS Name: (2S)-2-[[[(2S)-1-(2-ammonio-1-oxoethyl)-2-pyrrolidinyl]-oxomethyl]amino]-4-pentynoate IUPAC Name: (2S)-2-[[(2S)-1-(2-azaniumylacetyl)pyrrolidine-2-carbonyl]amino]pent-4-ynoate Traditional Name: (2S)-2-[[(2S)-1-(2-ammonioacetyl)prolyl]amino]pent-4-ynoate Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC(C(=O)[O-])NC(=O)C1CCCN1C(=O)C[NH3+]

Isomeric SMILES

C#CC[C@@H](C(=O)[O-])NC(=O)[C@@H]1CCCN1C(=O)C[NH3+]

InChI

InChI=1S/C12H17N3O4/c1-2-4-8(12(18)19)14-11(17)9-5-3-6-15(9)10(16)7-13/h1,8-9H,3-7,13H2,(H,14,17)(H,18,19)/t8-,9-/m0/s1