(2S,3R)-2-[[(2S)-5-azanyl-4-methylidene-2,3-dihydropyrrol-2-yl]carbonylamino]-3-oxidanyl-butanoic acid

Systemtic Name: (2S,3R)-2-[[(2S)-5-azanyl-4-methylidene-2,3-dihydropyrrol-2-yl]carbonylamino]-3-oxidanyl-butanoic acid Openeye Name: (2S,3R)-2-[[(2S)-5-amino-4-methylene-2,3-dihydropyrrole-2-carbonyl]amino]-3-hydroxy-butanoic acid CAS Name: (2S,3R)-2-[[[(2S)-5-amino-4-methylene-2,3-dihydropyrrol-2-yl]-oxomethyl]amino]-3-hydroxybutanoic acid IUPAC Name: (2S,3R)-2-[[(2S)-5-amino-4-methylidene-2,3-dihydropyrrole-2-carbonyl]amino]-3-hydroxybutanoic acid Traditional Name: (2S,3R)-2-[[(2S)-5-amino-4-methylene-1-pyrroline-2-carbonyl]amino]-3-hydroxy-butyric acid Formula: C10H15N3O4 MolecularWeight: 241.2438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C1CC(=C)C(=N1)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)O)NC(=O)[C@@H]1CC(=C)C(=N1)N)O

InChI

InChI=1S/C10H15N3O4/c1-4-3-6(12-8(4)11)9(15)13-7(5(2)14)10(16)17/h5-7,14H,1,3H2,2H3,(H2,11,12)(H,13,15)(H,16,17)/t5-,6+,7+/m1/s1